Glycoside
...
GD117958

Name:
methyl 4-{2-[2-(3,4-dihydroxyphenyl)-2-methoxyethoxy]-2-oxoethyl}-3-(2-hydroxyethylidene)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-carboxylate

Formula:
C26H34O15

Smiles:
COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C(=CCO)C1CC(=O)OCC(OC)c1ccc(O)c(O)c1

Aglycone:
COC(=O)C1=COC(O)C(=CCO)C1CC(=O)OCC(OC)c1ccc(O)c(O)c1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 3
HBD: 7 FractionCSP3: 0.54
AlogP: -1.52 Num_rotatable_bonds: 11
MolWt: 586.54 Num_heavy_atoms: 41
TPSA: 231.13 NumAromaticRings: 1

Unique Aglycone
AD47104
Formula: C20H24O10

Smiles:
COC(=O)C1=COC(O)C(=CCO)C1CC(=O)OCC(OC)c1ccc(O)c(O)c1
HBA: 10 RingCount: 2
HBD: 4 FractionCSP3: 0.4
AlogP: 0.66 Num_rotatable_bonds: 8
MolWt: 424.4 Num_heavy_atoms: 30
TPSA: 151.98 NumAromaticRings: 1

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O