Glycoside
...
GD036877

Name:
None

Formula:
C17H22O8

Smiles:
C=CC(=O)Oc1ccc(CCO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1

Aglycone:
C=CC(=O)Oc1ccc(CCO)cc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 8 RingCount: 2
HBD: 4 FractionCSP3: 0.47
AlogP: -0.86 Num_rotatable_bonds: 7
MolWt: 354.35 Num_heavy_atoms: 25
TPSA: 125.68 NumAromaticRings: 1

Unique Aglycone
AD23250
Formula: C11H12O3

Smiles:
C=CC(=O)Oc1ccc(CCO)cc1
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.18
AlogP: 1.31 Num_rotatable_bonds: 4
MolWt: 192.21 Num_heavy_atoms: 14
TPSA: 46.53 NumAromaticRings: 1

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O