Glycoside
...
GD116721

Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 1,9-dihydroxy-7-(hydroxymethyl)-4',4',4a,4b,7-pentamethyl-5',8-dioxo-3,4,4a,4b,5,6,6a,7,8,9,10,10a,10b,11-tetradecahydro-1H-spiro[chrysene-2,1'-cyclopentane]-10a-carboxylate

Formula:
C35H52O12

Smiles:
CC1(C)CCC2(CCC3(C)C(=CCC4C5(C(=O)OC6OC(CO)C(O)C(O)C6O)CC(O)C(=O)C(C)(CO)C5CCC43C)C2O)C1=O

Aglycone:
CC1(C)CCC2(CCC3(C)C(=CCC4C5(C(=O)O)CC(O)C(=O)C(C)(CO)C5CCC43C)C2O)C1=O

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

Other Identifiers

Properties
HBA: 12 RingCount: 6
HBD: 7 FractionCSP3: 0.86
AlogP: 0.55 Num_rotatable_bonds: 4
MolWt: 664.79 Num_heavy_atoms: 47
TPSA: 211.28 NumAromaticRings: 0

Unique Aglycone
AD46404
Formula: C29H42O7

Smiles:
CC1(C)CCC2(CCC3(C)C(=CCC4C5(C(=O)O)CC(O)C(=O)C(C)(CO)C5CCC43C)C2O)C1=O
HBA: 7 RingCount: 5
HBD: 4 FractionCSP3: 0.83
AlogP: 3.29 Num_rotatable_bonds: 2
MolWt: 502.65 Num_heavy_atoms: 36
TPSA: 132.13 NumAromaticRings: 0

Sugarmoiety
SD00003

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