Glycoside
...
GD033798

Name:
None

Formula:
C22H24O9

Smiles:
COc1ccc(-c2ccco2)cc1[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
COC(C)=O.COc1ccc(-c2ccco2)cc1

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

Other Identifiers

Properties
HBA: 9 RingCount: 3
HBD: 0 FractionCSP3: 0.41
AlogP: 2.82 Num_rotatable_bonds: 7
MolWt: 432.43 Num_heavy_atoms: 31
TPSA: 110.5 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
AD21549
Formula: C11H10O2

Smiles:
COc1ccc(-c2ccco2)cc1
HBA: 2 RingCount: 2
HBD: 0 FractionCSP3: 0.09
AlogP: 2.96 Num_rotatable_bonds: 2
MolWt: 174.2 Num_heavy_atoms: 13
TPSA: 22.37 NumAromaticRings: 2

Sugarmoiety
SD00105

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