Glycoside
...
GD034404

Name:
None

Formula:
C17H22O7

Smiles:
C=CCc1ccc(O[C@@H]2O[C@H](COC(C)=O)[C@H](O)[C@H](O)[C@H]2O)cc1

Aglycone:
C=CCc1ccc(O)cc1.COC(C)=O

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 7 RingCount: 2
HBD: 3 FractionCSP3: 0.47
AlogP: 0.16 Num_rotatable_bonds: 6
MolWt: 338.36 Num_heavy_atoms: 24
TPSA: 105.45 NumAromaticRings: 1

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
AD00473
Formula: C9H10O

Smiles:
C=CCc1ccc(O)cc1
HBA: 1 RingCount: 1
HBD: 1 FractionCSP3: 0.11
AlogP: 2.12 Num_rotatable_bonds: 2
MolWt: 134.18 Num_heavy_atoms: 10
TPSA: 20.23 NumAromaticRings: 1

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O