Glycoside
...
GD017732

Name:
[3,4-bis(acetyloxy)-6-{4-[3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2,3-dihydroxyphenoxy}-5-hydroxyoxan-2-yl]methyl acetate

Formula:
C27H28O14

Smiles:
CC(=O)OC[C@@H]1O[C@H](Oc2ccc(C(=O)C=Cc3ccc(O)c(O)c3)c(O)c2O)[C@H](O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
COC(C)=O.O=C(C=Cc1ccc(O)c(O)c1)c1ccc(O)c(O)c1O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(O)C1OC(C)=O

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 5 FractionCSP3: 0.33
AlogP: 1.3 Num_rotatable_bonds: 9
MolWt: 576.51 Num_heavy_atoms: 41
TPSA: 215.58 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
AD12625
Formula: C15H12O6

Smiles:
O=C(C=Cc1ccc(O)c(O)c1)c1ccc(O)c(O)c1O
HBA: 6 RingCount: 2
HBD: 5 FractionCSP3: 0.0
AlogP: 2.11 Num_rotatable_bonds: 3
MolWt: 288.25 Num_heavy_atoms: 21
TPSA: 118.22 NumAromaticRings: 2

Sugarmoiety
SD00013

CC(=O)OC1C(O)OC(O)C(O)C1OC(C)=O