Glycoside
...
GD117715

Name:
Albidoside

Formula:
C25H30O12

Smiles:
CC1(O)CCC2C(C(=O)O)=COC(OC3OC(COC(=O)C=Cc4ccc(O)cc4)C(O)C(O)C3O)C21

Aglycone:
CC1(O)CCC2C(C(=O)O)=COC(O)C21.COC(=O)C=Cc1ccc(O)cc1

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

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 6 FractionCSP3: 0.52
AlogP: -0.13 Num_rotatable_bonds: 7
MolWt: 522.5 Num_heavy_atoms: 37
TPSA: 192.44 NumAromaticRings: 1

Unique Aglycone
AD00020
Formula: C10H10O3

Smiles:
COC(=O)C=Cc1ccc(O)cc1
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.1
AlogP: 1.58 Num_rotatable_bonds: 2
MolWt: 178.19 Num_heavy_atoms: 13
TPSA: 46.53 NumAromaticRings: 1
AD10227
Formula: C10H14O5

Smiles:
CC1(O)CCC2C(C(=O)O)=COC(O)C21
HBA: 5 RingCount: 2
HBD: 3 FractionCSP3: 0.7
AlogP: 0.08 Num_rotatable_bonds: 1
MolWt: 214.22 Num_heavy_atoms: 15
TPSA: 86.99 NumAromaticRings: 0

Sugarmoiety
SD00017

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