Glycoside
...
GD110234

Name:
None

Formula:
C29H28O12

Smiles:
CC(=O)OC[C@@H]1O[C@@H](Oc2ccc3c(=O)c(-c4ccccc4)coc3c2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
COC(C)=O.O=c1c(-c2ccccc2)coc2cc(O)ccc12

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

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 0 FractionCSP3: 0.34
AlogP: 2.92 Num_rotatable_bonds: 8
MolWt: 568.53 Num_heavy_atoms: 41
TPSA: 153.87 NumAromaticRings: 3

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
AD37156
Formula: C15H10O3

Smiles:
O=c1c(-c2ccccc2)coc2cc(O)ccc12
HBA: 3 RingCount: 3
HBD: 1 FractionCSP3: 0.0
AlogP: 3.17 Num_rotatable_bonds: 1
MolWt: 238.24 Num_heavy_atoms: 18
TPSA: 50.44 NumAromaticRings: 3

Sugarmoiety
SD00012

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