Glycoside
...
GD114421

Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 2-[1,10,11-trihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicen-4a-yl]acetate

Formula:
C37H60O11

Smiles:
CC1CCC2(CC(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1(C)O

Aglycone:
CC1CCC2(CC(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1(C)O

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

Other Identifiers

Properties
HBA: 11 RingCount: 6
HBD: 8 FractionCSP3: 0.92
AlogP: 1.8 Num_rotatable_bonds: 5
MolWt: 680.88 Num_heavy_atoms: 48
TPSA: 197.37 NumAromaticRings: 0

Unique Aglycone
AD45047
Formula: C31H50O6

Smiles:
CC1CCC2(CC(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1(C)O
HBA: 6 RingCount: 5
HBD: 5 FractionCSP3: 0.9
AlogP: 4.54 Num_rotatable_bonds: 3
MolWt: 518.74 Num_heavy_atoms: 37
TPSA: 118.22 NumAromaticRings: 0

Sugarmoiety
SD00003

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