Glycoside
...
GD010662

Name:
None

Formula:
C26H42O10

Smiles:
CC(C)(O)[C@@H]1CC=C(C(=O)OC[C@@H]2O[C@H](OC(=O)[C@H]3CC[C@@H](C(C)(C)O)CC3)[C@H](O)[C@H](O)[C@H]2O)CC1

Aglycone:
CC(C)(O)C1CCC(C(=O)O)CC1.COC(=O)C1=CCC(C(C)(C)O)CC1

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

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 5 FractionCSP3: 0.85
AlogP: 0.96 Num_rotatable_bonds: 7
MolWt: 514.61 Num_heavy_atoms: 36
TPSA: 162.98 NumAromaticRings: 0

Unique Aglycone
AD04696
Formula: C11H18O3

Smiles:
COC(=O)C1=CCC(C(C)(C)O)CC1
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.73
AlogP: 1.66 Num_rotatable_bonds: 2
MolWt: 198.26 Num_heavy_atoms: 14
TPSA: 46.53 NumAromaticRings: 0
AD08205
Formula: C10H18O3

Smiles:
CC(C)(O)C1CCC(C(=O)O)CC1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.9
AlogP: 1.65 Num_rotatable_bonds: 2
MolWt: 186.25 Num_heavy_atoms: 13
TPSA: 57.53 NumAromaticRings: 0

Sugarmoiety
SD00017

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