MiMeDB: Showing metabocard for Delphinidin 3-O-(coumaroylglucoside) (MMDBc0033620)

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2021-11-19 04:56:13 UTC

Update Date

2022-08-31 22:37:08 UTC

Metabolite ID

MMDBc0033620

Metabolite Identification

Common Name

Delphinidin 3-O-(coumaroylglucoside)

Description

Delphinidin 3-O-(coumaroylglucoside) is an anthocyanin, which is a class of polyphenol. Anthocyanins are plant pigments found in many red berries including grape and grape skin. The cell wall of S. cerevisiae is permeable to anthocyanins and as a consequence the anthocyanins can be retained by yeast during wine-making; this adsorption can have an influence on wine color. Anthocyanins can react with yeast metabolites to form pyranoanthocyanins, which are more stable pigments formed during wine ageing and are of great importance for the color of aged wines. [PMID: 12822951 ] [PMID: 17303275 ]

Structure

MOL SDF PDB SMILES InChI

Delphinidin 3-O-(6"-p-coumaroyl-glucoside)
  Mrv1652309231718122D          

 44 48  0  0  1  0            999 V2000
    0.0000    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.4749    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.7145    2.0625    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.4289    2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    4.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    4.9499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    5.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    6.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    7.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    7.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    8.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    7.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    6.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2374    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.0625    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4289    2.4749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  2  3  1  0  0  0  0
  3  4  1  6  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  2  0  0  0  0
 10 16  1  0  0  0  0
  3 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  6  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 28 29  2  0  0  0  0
 22 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 20 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 34 36  2  0  0  0  0
 36 37  1  0  0  0  0
 36 38  1  0  0  0  0
 38 39  1  0  0  0  0
 38 40  2  0  0  0  0
 32 40  1  0  0  0  0
 18 41  1  0  0  0  0
 41 42  1  1  0  0  0
 41 43  1  0  0  0  0
  2 43  1  0  0  0  0
 43 44  1  6  0  0  0
M  CHG  1  30   1
M  END

Delphinidin 3-O-(6"-p-coumaroyl-glucoside)
  Mrv1652309231718122D          

 44 48  0  0  1  0            999 V2000
    0.0000    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.4749    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.7145    2.0625    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.4289    2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    4.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    4.9499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    5.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    6.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    7.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    7.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    8.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    7.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    6.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2374    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.0625    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4289    2.4749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  2  3  1  0  0  0  0
  3  4  1  6  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  2  0  0  0  0
 10 16  1  0  0  0  0
  3 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  6  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 28 29  2  0  0  0  0
 22 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 20 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 34 36  2  0  0  0  0
 36 37  1  0  0  0  0
 36 38  1  0  0  0  0
 38 39  1  0  0  0  0
 38 40  2  0  0  0  0
 32 40  1  0  0  0  0
 18 41  1  0  0  0  0
 41 42  1  1  0  0  0
 41 43  1  0  0  0  0
  2 43  1  0  0  0  0
 43 44  1  6  0  0  0
M  CHG  1  30   1
M  END
> <DATABASE_ID>
MMDBc0033620

> <DATABASE_NAME>
MIME

> <SMILES>
O[C@@H]1[C@@H](COC(=O)\C=C\C2=CC=C(O)C=C2)O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C30H26O14/c31-15-4-1-13(2-5-15)3-6-24(36)41-12-23-26(38)27(39)28(40)30(44-23)43-22-11-17-18(33)9-16(32)10-21(17)42-29(22)14-7-19(34)25(37)20(35)8-14/h1-11,23,26-28,30,38-40H,12H2,(H5-,31,32,33,34,35,36,37)/p+1/t23-,26-,27+,28-,30-/m1/s1

> <INCHI_KEY>
DHTPVCYNNWQRMN-LHRGPQAGSA-O

> <FORMULA>
C30H27O14

> <MOLECULAR_WEIGHT>
611.527

> <EXACT_MASS>
611.140080572

> <JCHEM_ACCEPTOR_COUNT>
13

> <JCHEM_ATOM_COUNT>
71

> <JCHEM_AVERAGE_POLARIZABILITY>
59.17477395131911

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
1

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-1lambda4-chromen-1-ylium

> <ALOGPS_LOGP>
3.08

> <JCHEM_LOGP>
3.5162999999999993

> <ALOGPS_LOGS>
-3.75

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
7.290540311325717

> <JCHEM_PKA_STRONGEST_ACIDIC>
6.366206630280111

> <JCHEM_PKA_STRONGEST_BASIC>
-3.678969695794679

> <JCHEM_POLAR_SURFACE_AREA>
239.96999999999997

> <JCHEM_REFRACTIVITY>
159.78700000000003

> <JCHEM_ROTATABLE_BOND_COUNT>
8

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.14e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-1lambda4-chromen-1-ylium

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 23-SEP-17   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: Delphinidin 3-O-(6"-p-coumaroyl-glucoside)        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-SEP-17         0                                  
HETATM    1  O   UNK     0       0.000   6.160   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0       0.000   4.620   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -1.334   3.850   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -2.667   4.620   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0      -2.667   6.160   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0      -4.001   6.930   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0      -5.335   6.160   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0      -4.001   8.470   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -2.667   9.240   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -2.667  10.780   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -4.001  11.550   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -4.001  13.090   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -2.667  13.860   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0      -2.667  15.400   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0      -1.334  13.090   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -1.334  11.550   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0      -1.334   2.310   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0       0.000   1.540   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0       0.000   0.000   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       2.667   0.000   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0       5.335   1.540   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0       6.668  -0.770   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       6.668  -2.310   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       8.002  -3.080   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0       5.335  -3.080   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   30  O   UNK     0       2.667  -3.080   0.000  0.00  0.00           O+1
HETATM   31  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       0.000  -3.080   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0       0.000  -4.620   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      -1.334  -5.390   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0      -1.334  -6.930   0.000  0.00  0.00           O+0
HETATM   36  C   UNK     0      -2.667  -4.620   0.000  0.00  0.00           C+0
HETATM   37  O   UNK     0      -4.001  -5.390   0.000  0.00  0.00           O+0
HETATM   38  C   UNK     0      -2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   39  O   UNK     0      -4.001  -2.310   0.000  0.00  0.00           O+0
HETATM   40  C   UNK     0      -1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0       1.334   2.310   0.000  0.00  0.00           C+0
HETATM   42  O   UNK     0       2.667   1.540   0.000  0.00  0.00           O+0
HETATM   43  C   UNK     0       1.334   3.850   0.000  0.00  0.00           C+0
HETATM   44  O   UNK     0       2.667   4.620   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   43                                                  
CONECT    3    2    4   17                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7    8                                                  
CONECT    7    6                                                            
CONECT    8    6    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11   16                                                  
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13   16                                                       
CONECT   16   15   10                                                       
CONECT   17    3   18                                                       
CONECT   18   17   19   41                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21   31                                                  
CONECT   21   20   22                                                       
CONECT   22   21   23   29                                                  
CONECT   23   22   24   25                                                  
CONECT   24   23                                                            
CONECT   25   23   26                                                       
CONECT   26   25   27   28                                                  
CONECT   27   26                                                            
CONECT   28   26   29                                                       
CONECT   29   28   22   30                                                  
CONECT   30   29   31                                                       
CONECT   31   30   20   32                                                  
CONECT   32   31   33   40                                                  
CONECT   33   32   34                                                       
CONECT   34   33   35   36                                                  
CONECT   35   34                                                            
CONECT   36   34   37   38                                                  
CONECT   37   36                                                            
CONECT   38   36   39   40                                                  
CONECT   39   38                                                            
CONECT   40   38   32                                                       
CONECT   41   18   42   43                                                  
CONECT   42   41                                                            
CONECT   43   41    2   44                                                  
CONECT   44   43                                                            
MASTER        0    0    0    0    0    0    0    0   44    0   96    0
END

Synonyms

Value	Source
Delfinidin 3-O-(6-O-(Z)-4-coumaroyl-beta-D-glucoside)	ChEBI
Delfinidin 3-O-(6-O-(Z)-p-coumaroyl-beta-D-glucoside)	ChEBI
Delfinidin 3-O-(6-O-(Z)-4-coumaroyl-b-D-glucoside)	Generator
Delfinidin 3-O-(6-O-(Z)-4-coumaroyl-β-D-glucoside)	Generator
Delfinidin 3-O-(6-O-(Z)-p-coumaroyl-b-D-glucoside)	Generator
Delfinidin 3-O-(6-O-(Z)-p-coumaroyl-β-D-glucoside)	Generator

Molecular Formula

C₃₀H₂₇O₁₄

Average Mass

611.527

Monoisotopic Mass

611.140080572

IUPAC Name

5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-1lambda4-chromen-1-ylium

Traditional Name

5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-1lambda4-chromen-1-ylium

CAS Registry Number

Not Available

SMILES

O[C@@H]1[C@@H](COC(=O)\C=C\C2=CC=C(O)C=C2)O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O

InChI Identifier

InChI=1S/C30H26O14/c31-15-4-1-13(2-5-15)3-6-24(36)41-12-23-26(38)27(39)28(40)30(44-23)43-22-11-17-18(33)9-16(32)10-21(17)42-29(22)14-7-19(34)25(37)20(35)8-14/h1-11,23,26-28,30,38-40H,12H2,(H5-,31,32,33,34,35,36,37)/p+1/t23-,26-,27+,28-,30-/m1/s1

InChI Key

DHTPVCYNNWQRMN-LHRGPQAGSA-O

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as anthocyanidin 3-o-6-p-coumaroyl glycosides. These are anthocyanidin 3-O-glycosides where the carbohydrate moiety is esterified at the C6 position with a p-coumaric acid. P-coumaric acid is an organic derivative of cinnamic acid, that carries a hydroxyl group at the 4-position of the benzene ring.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavonoid glycosides

Direct Parent

Anthocyanidin 3-O-6-p-coumaroyl glycosides

Alternative Parents

Substituents

Anthocyanidin 3-o-6-p-coumaroyl-glycoside
Anthocyanidin-3-o-glycoside
Anthocyanin
Flavonoid-3-o-glycoside
Hydroxyflavonoid
3'-hydroxyflavonoid
4'-hydroxyflavonoid
5-hydroxyflavonoid
7-hydroxyflavonoid
Anthocyanidin
Coumaric acid ester
Hydroxycinnamic acid or derivatives
Coumaric acid or derivatives
Cinnamic acid ester
Cinnamic acid or derivatives
O-glycosyl compound
Glycosyl compound
1-benzopyran
Benzopyran
Pyrogallol derivative
Benzenetriol
Styrene
1-hydroxy-2-unsubstituted benzenoid
1-hydroxy-4-unsubstituted benzenoid
Phenol
Fatty acid ester
Fatty acyl
Benzenoid
Monocyclic benzene moiety
Oxane
Monosaccharide
Heteroaromatic compound
Alpha,beta-unsaturated carboxylic ester
Enoate ester
Secondary alcohol
Carboxylic acid ester
Monocarboxylic acid or derivatives
Acetal
Polyol
Oxacycle
Organoheterocyclic compound
Carboxylic acid derivative
Organic oxygen compound
Organooxygen compound
Organic oxide
Hydrocarbon derivative
Alcohol
Carbonyl group
Organic cation
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

beta-D-glucoside (CHEBI:75675 )
anthocyanin cation (CHEBI:75675 )
cinnamate ester (CHEBI:75675 )
polyphenol (CHEBI:75675 )
Anthocyanidins (C16370 )
Anthocyanidins and anthocyanins (C16370 )

Functional Ontology

Not Available

Physical Properties

State

Expected Solid

Predicted Properties

Property	Value	Source
Water Solubility	0.11 g/L	ALOGPS
logP	3.08	ALOGPS
logP	3.52	ChemAxon
logS	-3.8	ALOGPS
pKa (Strongest Acidic)	6.37	ChemAxon
pKa (Strongest Basic)	-3.7	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	13	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	239.97 Å²	ChemAxon
Rotatable Bond Count	8	ChemAxon
Refractivity	159.79 m³·mol⁻¹	ChemAxon
Polarizability	59.17 Å³	ChemAxon
Number of Rings	5	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Spectra

Spectrum Type	Description	Splash Key	Deposition Date	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Positive	splash10-03di-0000009000-8e53288d22819bc00aa8	2016-09-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Positive	splash10-014i-0000009000-a80c634c9d6a072263b0	2016-09-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Positive	splash10-0udi-0924006000-c95b16a92aad8078a71e	2016-09-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Negative	splash10-03di-0000009000-df4ecf77dd14a5367957	2016-09-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Negative	splash10-03di-1000009000-3c05571308dc0260f877	2016-09-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Negative	splash10-056r-7920000000-4b1c5538034feb0ae6fd	2016-09-12	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 100 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 200 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 300 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 400 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 500 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 600 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 700 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 800 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 900 MHz, H₂O, predicted)		2022-08-21	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, H₂O, predicted)		2022-08-21	View Spectrum

Chromatographic Retention Times and Retention Indices

Retention Times

Chromatography Type	Technique	Column	Deposition Date	Retention Time (s)
Liquid Chromatography	HILIC	Waters Acquity UPLC-BEH Amide column (eluted)	2025-10-24	91.1
Liquid Chromatography	HILIC	Accucore 150 Amide HILIC (eluted)	2025-10-24	90.6
Liquid Chromatography	Reversed-phase	Hypersil Gold 1.9 µm C18 (eluted)	2025-10-24	411.9
Liquid Chromatography	Reversed-phase	Agilent Zorbax Eclipse Plus C18 (2.1 mm x 150 mm, 3.5 um) (eluted)	2025-10-24	466.8
Liquid Chromatography	Reversed-phase	XBridge C18 3.5u 2.1x50 mm (eluted)	2025-10-24	466.9
Liquid Chromatography	Reversed-phase	Ascentis Express C18 (eluted)	2025-10-24	168.3
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	1819.3
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-24	383.2
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC (eluted)	2025-10-24	371.3
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	172.0
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-24	144.7
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	134.8
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	90.2
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-24	422.9
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-24	404.1
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	85.5
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	300.3
Liquid Chromatography	Reversed-phase	Kinetex Core-Shell C18 2.6 um, 3.0 x 100 mm, Phenomenex (eluted)	2025-10-24	1811.3
Liquid Chromatography	Reversed-phase	Waters Atlantis T3 (2.1 x 150 mm, 5 um) (eluted)	2025-10-24	673.0

Retention Indices

Chromatography Type	Peak Label	SMILES	Stationary Phase	Deposition Date	Retention Index
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_1	C[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=C(O)C=C2)O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O	standard non polar	2025-10-24	2339.56
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_2	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	1862.31
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_3	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C=C12	standard non polar	2025-10-24	1426.15
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_4	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2609.94
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_5	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	standard non polar	2025-10-24	2695.06
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_6	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)C=C1O	standard non polar	2025-10-24	1153.42
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_7	C[Si](C)(C)O[C@H]1[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](COC(=O)/C=C/C2=CC=C(O)C=C2)[C@@H](O)[C@@H]1O	standard non polar	2025-10-24	3687.94
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_8	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](COC(=O)/C=C/C2=CC=C(O)C=C2)[C@H]1O	standard non polar	2025-10-24	1770.95
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_9	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1146.05
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_10	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C=C12	standard non polar	2025-10-24	1741.73
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_11	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1588.96
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_12	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	standard non polar	2025-10-24	2007.83
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_13	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)C=C1O	standard non polar	2025-10-24	1811.44
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_14	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@@H]1COC(=O)/C=C/C1=CC=C(O)C=C1	standard non polar	2025-10-24	1336.34
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_15	C[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=C(O)C=C2)O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	standard non polar	2025-10-24	2805.65
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_16	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	617.887
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_17	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	3530.75
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_18	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	1015.7
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_19	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2963.45
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_20	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2287.85
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_21	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	683.061
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_22	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1928.93
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_23	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	standard non polar	2025-10-24	2359.41
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_24	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)C=C1O	standard non polar	2025-10-24	1323.34
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_25	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C=C12	standard non polar	2025-10-24	1614.51
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_26	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C=C12	standard non polar	2025-10-24	2178.82
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_27	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	762.614
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_28	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	635.51
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_29	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1839.1
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_30	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	994.548
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_31	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	standard non polar	2025-10-24	1865.62
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_32	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard non polar	2025-10-24	1424.29
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_33	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard non polar	2025-10-24	2918.78
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_34	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard non polar	2025-10-24	1150.44
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_35	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	standard non polar	2025-10-24	1562.89
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_36	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	standard non polar	2025-10-24	1484.11
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_37	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](COC(=O)/C=C/C2=CC=C(O)C=C2)[C@H]1O	standard non polar	2025-10-24	1025.22
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_38	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1041.9
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_39	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	902.057
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_40	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	2597.16
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_41	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1632.98
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_42	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1791.71
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_43	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1379.0
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_44	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2932.87
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_45	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	standard non polar	2025-10-24	2246.53
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_46	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)C=C1O	standard non polar	2025-10-24	2198.64
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_47	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C=C12	standard non polar	2025-10-24	1741.13
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_48	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C=C12	standard non polar	2025-10-24	1960.24
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_49	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	758.504
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_50	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1570.74
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_51	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1310.28
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_52	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	-210.313
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_53	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	standard non polar	2025-10-24	927.578
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_54	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard non polar	2025-10-24	2597.97
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_55	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard non polar	2025-10-24	2324.08
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_56	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard non polar	2025-10-24	2371.87
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_57	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	standard non polar	2025-10-24	1005.77
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_58	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	standard non polar	2025-10-24	1615.28
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_59	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](COC(=O)/C=C/C2=CC=C(O)C=C2)[C@H]1O[Si](C)(C)C	standard non polar	2025-10-24	831.223
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_60	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2477.95
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_61	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	879.1
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_62	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	1555.45
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_63	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	1525.19
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_64	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	1665.74
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_65	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	1960.82
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_66	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	665.416
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_67	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2319.57
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_68	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	530.139
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_69	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	3145.58
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_70	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	1963.8
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_71	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2971.55
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_72	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	1261.77
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_73	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2247.54
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_74	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	2184.13
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_75	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	1787.49
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_76	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2157.26
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_77	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2374.24
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_78	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1656.53
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_79	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1539.06
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_80	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	standard non polar	2025-10-24	4334.66
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_81	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard non polar	2025-10-24	1949.27
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_82	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard non polar	2025-10-24	1983.29
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_83	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard non polar	2025-10-24	1340.79
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_84	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	standard non polar	2025-10-24	2996.16
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_85	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	standard non polar	2025-10-24	2081.45
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_86	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C=C12	standard non polar	2025-10-24	1806.15
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_87	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	624.361
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_88	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2028.15
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_89	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1957.89
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_90	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1127.9
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_91	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2233.97
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_92	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2731.33
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_93	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2691.71
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_94	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard non polar	2025-10-24	147.715
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_95	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard non polar	2025-10-24	973.876
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_96	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard non polar	2025-10-24	2505.19
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_97	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	standard non polar	2025-10-24	2341.21
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_98	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	standard non polar	2025-10-24	2067.82
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_99	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	standard non polar	2025-10-24	1384.52
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_100	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	standard non polar	2025-10-24	815.951
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_101	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	889.287
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_102	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1065.46
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_103	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1058.12
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_104	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	3420.51
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_105	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	579.366
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_106	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1085.97
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_107	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1761.93
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_108	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	2796.72
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_109	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1600.75
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_110	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	720.028
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_111	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1562.97
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_112	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	3855.02
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_113	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1356.52
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_114	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1901.62
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_115	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1918.16
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_116	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard non polar	2025-10-24	1989.04
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_117	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1728.28
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_118	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2518.0
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_119	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2374.76
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_120	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2049.8
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_121	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	standard non polar	2025-10-24	1617.29
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_122	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard non polar	2025-10-24	1483.04
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_123	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard non polar	2025-10-24	2609.65
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_124	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard non polar	2025-10-24	1325.26
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_125	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	standard non polar	2025-10-24	1214.74
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_126	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	standard non polar	2025-10-24	1818.4
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_127	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C=C12	standard non polar	2025-10-24	1979.76
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_128	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1653.37
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_129	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1587.71
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_130	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	3340.18
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_131	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1775.45
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_132	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	4082.57
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_133	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1528.47
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_134	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2206.95
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_135	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard non polar	2025-10-24	3357.47
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_136	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard non polar	2025-10-24	207.529
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_137	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard non polar	2025-10-24	1718.85
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_138	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	standard non polar	2025-10-24	1903.46
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_139	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	standard non polar	2025-10-24	3541.5
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_140	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	standard non polar	2025-10-24	2987.64
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_141	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	standard non polar	2025-10-24	1704.01
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_142	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2651.75
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_143	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2292.04
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_144	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2310.59
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_145	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	542.485
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_146	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	3060.89
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_147	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2838.17
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_148	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2682.74
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_149	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	-321.494
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_150	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	1237.52
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_151	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	-258.375
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_152	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	984.585
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_153	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	1650.72
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_154	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	1667.37
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_155	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	1404.64
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_156	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	1871.78
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_157	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	3390.81
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_158	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	1223.96
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_159	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	-109.361
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_160	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2282.76
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_161	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	3461.23
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_162	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	558.935
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_163	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard non polar	2025-10-24	2626.5
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_164	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	2851.83
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_165	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	897.404
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_166	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard non polar	2025-10-24	2470.26
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_167	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2416.72
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_168	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	757.354
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_169	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	658.947
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_170	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1500.57
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_171	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2912.14
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_172	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	-181.899
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_173	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	4198.81
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_174	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard non polar	2025-10-24	2059.58
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_175	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard non polar	2025-10-24	878.688
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_176	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard non polar	2025-10-24	1967.59
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_177	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	standard non polar	2025-10-24	1510.92
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_178	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	standard non polar	2025-10-24	1405.1
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_179	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	standard non polar	2025-10-24	2522.17
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_180	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	standard non polar	2025-10-24	3228.63
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_181	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2066.47
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_182	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard non polar	2025-10-24	438.9
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_183	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	1768.73
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_184	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2167.54
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_185	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2642.47
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_186	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	576.051
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_187	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard non polar	2025-10-24	2536.34
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_188	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	standard non polar	2025-10-24	2425.06
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_189	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	standard non polar	2025-10-24	1987.93
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_190	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	standard non polar	2025-10-24	1898.6
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_191	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	standard non polar	2025-10-24	1839.74
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_1	C[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=C(O)C=C2)O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O	standard polar	2025-10-24	934.049
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_2	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	3959.01
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_3	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C=C12	standard polar	2025-10-24	2408.94
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_4	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2304.58
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_5	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	standard polar	2025-10-24	2453.06
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_6	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)C=C1O	standard polar	2025-10-24	1648.14
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_7	C[Si](C)(C)O[C@H]1[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](COC(=O)/C=C/C2=CC=C(O)C=C2)[C@@H](O)[C@@H]1O	standard polar	2025-10-24	1765.85
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_8	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](COC(=O)/C=C/C2=CC=C(O)C=C2)[C@H]1O	standard polar	2025-10-24	1049.11
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_9	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	4439.72
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_10	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C=C12	standard polar	2025-10-24	3175.61
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_11	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2394.52
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_12	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	standard polar	2025-10-24	3788.22
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_13	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)C=C1O	standard polar	2025-10-24	2123.18
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_14	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@@H]1COC(=O)/C=C/C1=CC=C(O)C=C1	standard polar	2025-10-24	2547.0
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_15	C[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=C(O)C=C2)O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	standard polar	2025-10-24	1082.0
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_16	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1449.29
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_17	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	2803.53
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_18	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1290.86
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_19	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1662.33
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_20	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1437.05
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_21	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	2498.86
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_22	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	3936.03
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_23	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	standard polar	2025-10-24	2990.27
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_24	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)C=C1O	standard polar	2025-10-24	3025.92
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_25	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C=C12	standard polar	2025-10-24	1439.57
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_26	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C=C12	standard polar	2025-10-24	2123.67
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_27	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2808.86
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_28	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	1722.07
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_29	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	3430.94
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_30	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	338.594
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_31	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	standard polar	2025-10-24	2919.54
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_32	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard polar	2025-10-24	491.523
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_33	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard polar	2025-10-24	456.683
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_34	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard polar	2025-10-24	1762.95
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_35	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	standard polar	2025-10-24	2548.31
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_36	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	standard polar	2025-10-24	2655.2
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_37	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](COC(=O)/C=C/C2=CC=C(O)C=C2)[C@H]1O	standard polar	2025-10-24	1429.32
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_38	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	769.585
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_39	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	2156.6
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_40	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	2717.7
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_41	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	1532.52
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_42	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	2811.85
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_43	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	1191.64
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_44	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2661.72
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_45	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	standard polar	2025-10-24	664.163
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_46	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)C=C1O	standard polar	2025-10-24	1739.94
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_47	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C=C12	standard polar	2025-10-24	1839.83
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_48	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C=C12	standard polar	2025-10-24	1094.51
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_49	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2796.4
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_50	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2308.13
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_51	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	3369.62
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_52	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	1104.03
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_53	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	standard polar	2025-10-24	2298.76
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_54	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard polar	2025-10-24	2110.22
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_55	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard polar	2025-10-24	2741.99
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_56	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard polar	2025-10-24	2452.99
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_57	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	standard polar	2025-10-24	2574.08
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_58	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	standard polar	2025-10-24	3290.64
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_59	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](COC(=O)/C=C/C2=CC=C(O)C=C2)[C@H]1O[Si](C)(C)C	standard polar	2025-10-24	1569.56
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_60	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1654.3
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_61	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1988.41
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_62	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	3512.97
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_63	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1836.78
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_64	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	2495.67
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_65	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	2989.89
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_66	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	3375.08
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_67	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	3160.79
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_68	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	1415.29
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_69	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	3698.83
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_70	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	3178.72
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_71	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1762.14
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_72	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	3195.8
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_73	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	2768.33
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_74	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	1193.9
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_75	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	1988.09
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_76	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	3155.99
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_77	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2267.76
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_78	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	3199.3
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_79	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2055.99
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_80	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	standard polar	2025-10-24	1375.09
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_81	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard polar	2025-10-24	1349.39
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_82	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard polar	2025-10-24	694.7
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_83	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard polar	2025-10-24	2542.6
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_84	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	standard polar	2025-10-24	3794.68
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_85	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	standard polar	2025-10-24	647.476
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_86	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C=C12	standard polar	2025-10-24	1929.55
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_87	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	158.687
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_88	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	1984.48
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_89	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	3039.39
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_90	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	2984.65
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_91	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	1250.18
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_92	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	4820.01
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_93	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	4953.51
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_94	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard polar	2025-10-24	1931.27
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_95	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard polar	2025-10-24	1941.33
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_96	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard polar	2025-10-24	2953.62
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_97	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	standard polar	2025-10-24	3181.67
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_98	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	standard polar	2025-10-24	979.801
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_99	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	standard polar	2025-10-24	1535.17
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_100	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	standard polar	2025-10-24	2629.09
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_101	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	1756.8
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_102	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	2773.25
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_103	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	3405.02
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_104	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	1693.92
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_105	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	3353.38
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_106	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	2116.83
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_107	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	2596.71
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_108	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	1614.51
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_109	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	1875.15
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_110	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	1376.3
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_111	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	1416.01
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_112	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	2004.28
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_113	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	967.081
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_114	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	3108.14
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_115	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	1501.28
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_116	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)C=C1	standard polar	2025-10-24	619.578
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_117	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	334.783
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_118	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2588.34
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_119	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	1048.49
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_120	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	1058.95
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_121	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	standard polar	2025-10-24	2972.17
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_122	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard polar	2025-10-24	1629.75
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_123	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard polar	2025-10-24	2524.59
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_124	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard polar	2025-10-24	2371.38
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_125	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	standard polar	2025-10-24	799.999
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_126	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	standard polar	2025-10-24	2610.55
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_127	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C=C12	standard polar	2025-10-24	1456.65
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_128	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	1544.93
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_129	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	2381.38
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_130	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2678.91
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_131	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	2560.53
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_132	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2548.23
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_133	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	1619.26
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_134	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	3203.28
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_135	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard polar	2025-10-24	2396.64
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_136	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard polar	2025-10-24	-299.128
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_137	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard polar	2025-10-24	2390.05
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_138	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	standard polar	2025-10-24	1382.64
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_139	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	standard polar	2025-10-24	2678.22
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_140	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	standard polar	2025-10-24	381.707
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_141	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	standard polar	2025-10-24	2743.39
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_142	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	773.722
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_143	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1128.4
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_144	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1707.57
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_145	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	1345.99
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_146	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	2808.88
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_147	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	3264.49
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_148	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	2040.07
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_149	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	2641.74
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_150	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1341.51
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_151	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	3391.42
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_152	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	3909.12
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_153	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1755.88
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_154	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	3175.46
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_155	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1421.94
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_156	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	1320.26
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_157	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	1119.32
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_158	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	2224.85
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_159	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	1769.66
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_160	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	2981.27
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_161	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	3195.91
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_162	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	741.749
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_163	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)C=C1	standard polar	2025-10-24	2672.54
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_164	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	3362.29
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_165	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	3318.05
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_166	C[Si](C)(C)OC1=CC=C(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)C=C1	standard polar	2025-10-24	1683.5
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_167	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	2467.65
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_168	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	2630.68
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_169	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	3040.1
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_170	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	1936.83
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_171	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	1964.76
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_172	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	3677.97
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_173	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	1757.25
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_174	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	standard polar	2025-10-24	2598.98
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_175	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	standard polar	2025-10-24	1841.37
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_176	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	standard polar	2025-10-24	1655.51
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_177	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	standard polar	2025-10-24	1633.89
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_178	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	standard polar	2025-10-24	323.539
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_179	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	standard polar	2025-10-24	3543.45
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_180	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	standard polar	2025-10-24	1556.76
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_181	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	942.641
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_182	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	standard polar	2025-10-24	1809.19
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_183	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	2949.35
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_184	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	1186.59
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_185	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	1373.33
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_186	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	2189.7
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_187	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](COC(=O)/C=C/C4=CC=C(O)C=C4)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	standard polar	2025-10-24	1829.38
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_188	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	standard polar	2025-10-24	1260.79
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_189	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	standard polar	2025-10-24	2138.36
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_190	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	standard polar	2025-10-24	1331.35
Gas Chromatography	Delphinidin 3-O-(coumaroylglucoside)_TMS_191	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	standard polar	2025-10-24	1893.75

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Associated OMIM IDs

114500 (Colorectal cancer)
610247 (Eosinophilic esophagitis)

Human Proteins and Enzymes

Protein ID	Protein Name	Protein Type	Uniprot ID	Species

Human Pathways

Pathways

Name	SMPDB/PathBank

Microbial Pathways

Pathways

Not Available

Metabolic Reactions

Reactions

This table shows at most 20 reactions. For the full list of associated reactions:

See All Associated Reactions

Reaction ID	Precursor	Product	Enzyme	Reaction Type	Data Source	Reference

Health Effects and Bioactivity

Health Outcome/Bioactivity	Metabolite Response/Effect	Evidence Type	Host and Biospecimen	Data Source	Reference

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites	Microbial Links
Eukaryota/Fungi	Ascomycota	1	Human feces; Human saliva	Unknown

Exposure Sources

Other Exposures

Source Type	Data Source	Reference

Host Biospecimen and Location

Host and Biospecimen	Status	Mean	Std	Min	Max	Units	Age	Sex	Health Condition	Data Source	Reference

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

C00006878

Chemspider ID

Not Available

KEGG Compound ID

C16370

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

15922818

PDB ID

Not Available

ChEBI ID

75675

Food Biomarker Ontology

Not Available

CMMC Knowledgebase

Not Available

General References

Ramirez-Gaona M, Marcu A, Pon A, Guo AC, Sajed T, Wishart NA, Karu N, Djoumbou Feunang Y, Arndt D, Wishart DS: YMDB 2.0: a significantly expanded version of the yeast metabolome database. Nucleic Acids Res. 2017 Jan 4;45(D1):D440-D445. doi: 10.1093/nar/gkw1058. Epub 2016 Nov 28. [PubMed:27899612 ]

Showing metabocard for Delphinidin 3-O-(coumaroylglucoside) (MMDBc0033620)

MOL for #<Metabolite:0x00007f9abdc4b2b0>

3D MOL for #<Metabolite:0x00007f9abdc4b2b0>

3D SDF for #<Metabolite:0x00007f9abdc4b2b0>

3D-SDF for #<Metabolite:0x00007f9abdc4b2b0>

PDB for #<Metabolite:0x00007f9abdc4b2b0>

3D PDB for #<Metabolite:0x00007f9abdc4b2b0>

SMILES for #<Metabolite:0x00007f9abdc4b2b0>

INCHI for #<Metabolite:0x00007f9abdc4b2b0>

Structure for #<Metabolite:0x00007f9abdc4b2b0>

3D Structure for #<Metabolite:0x00007f9abdc4b2b0>