Glycoside
...
GD092757

Name:
None

Formula:
C20H32O10

Smiles:
CC(=O)OC[C@H]1O[C@@H](OC(=O)C(C)C)[C@H](O)[C@@H](OC(=O)C(C)C)[C@@H]1OC(=O)C(C)C

Aglycone:
CC(C)C(=O)O.CC(C)C(=O)O.CC(C)C(=O)O.COC(C)=O

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

Other Identifiers

Properties
HBA: 10 RingCount: 1
HBD: 1 FractionCSP3: 0.8
AlogP: 0.97 Num_rotatable_bonds: 8
MolWt: 432.47 Num_heavy_atoms: 30
TPSA: 134.66 NumAromaticRings: 0

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
AD00350
Formula: C4H8O2

Smiles:
CC(C)C(=O)O
HBA: 2 RingCount: 0
HBD: 1 FractionCSP3: 0.75
AlogP: 0.73 Num_rotatable_bonds: 1
MolWt: 88.11 Num_heavy_atoms: 6
TPSA: 37.3 NumAromaticRings: 0

Sugarmoiety
SD00017

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