Glycoside
...
GD156861

Name:
(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 2-{[3,4-bis(acetyloxy)-6-[(acetyloxy)methyl]-5-hydroxyoxan-2-yl]oxy}-6-hydroxybenzoate

Formula:
C32H38O18

Smiles:
CC(=O)OCC1OC(Oc2cccc(O)c2C(=O)OCc2ccccc2OC2OC(CO)C(O)C(O)C2O)C(OC(C)=O)C(OC(C)=O)C1O

Aglycone:
COC(C)=O.O=C(OCc1ccccc1O)c1c(O)cccc1O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(O)C1OC(C)=O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 18 RingCount: 4
HBD: 6 FractionCSP3: 0.5
AlogP: -1.18 Num_rotatable_bonds: 12
MolWt: 710.64 Num_heavy_atoms: 50
TPSA: 263.5 NumAromaticRings: 2

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD19085
Formula: C14H12O5

Smiles:
O=C(OCc1ccccc1O)c1c(O)cccc1O
HBA: 5 RingCount: 2
HBD: 3 FractionCSP3: 0.07
AlogP: 2.16 Num_rotatable_bonds: 3
MolWt: 260.24 Num_heavy_atoms: 19
TPSA: 86.99 NumAromaticRings: 2

Sugarmoiety
SD06453

CC(=O)OC1C(O)OC(O)C(O)C1OC(C)=O.OCC1OC(O)C(O)C(O)C1O