Glycoside
...
GD155509

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

Formula:
C27H34O15

Smiles:
COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C(=CCOC(C)=O)C1CC(=O)OCCc1ccc(O)c(O)c1

Aglycone:
COC(=O)C1=COC(O)C(=CCOC(C)=O)C1CC(=O)OCCc1ccc(O)c(O)c1

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

Other Identifiers

Properties
HBA: 15 RingCount: 3
HBD: 6 FractionCSP3: 0.52
AlogP: -1.09 Num_rotatable_bonds: 11
MolWt: 598.55 Num_heavy_atoms: 42
TPSA: 227.97 NumAromaticRings: 1

Unique Aglycone
AD54857
Formula: C21H24O10

Smiles:
COC(=O)C1=COC(O)C(=CCOC(C)=O)C1CC(=O)OCCc1ccc(O)c(O)c1
HBA: 10 RingCount: 2
HBD: 3 FractionCSP3: 0.38
AlogP: 1.08 Num_rotatable_bonds: 8
MolWt: 436.41 Num_heavy_atoms: 31
TPSA: 148.82 NumAromaticRings: 1

Sugarmoiety
SD00003

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