Glycoside
...
GD148167

Name:
1-hydroxy-1-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-3a,3b,6,6,9a-pentamethyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-hexadecahydro-1H-cyclopenta[a]phenanthren-11-yl acetate

Formula:
C38H64O11

Smiles:
CC(=O)OC1CC2C3(C)CCC(OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC2(C)C2(C)CCC(O)(C3(C)CCC(C(C)(C)O)O3)C12

Aglycone:
CC(=O)OC1CC2C3(C)CCC(O)C(C)(C)C3CCC2(C)C2(C)CCC(O)(C3(C)CCC(C(C)(C)O)O3)C12

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

Other Identifiers

Properties
HBA: 11 RingCount: 6
HBD: 6 FractionCSP3: 0.97
AlogP: 3.22 Num_rotatable_bonds: 6
MolWt: 696.92 Num_heavy_atoms: 49
TPSA: 175.37 NumAromaticRings: 0

Unique Aglycone
AD56471
Formula: C32H54O6

Smiles:
CC(=O)OC1CC2C3(C)CCC(O)C(C)(C)C3CCC2(C)C2(C)CCC(O)(C3(C)CCC(C(C)(C)O)O3)C12
HBA: 6 RingCount: 5
HBD: 3 FractionCSP3: 0.97
AlogP: 5.4 Num_rotatable_bonds: 3
MolWt: 534.78 Num_heavy_atoms: 38
TPSA: 96.22 NumAromaticRings: 0

Sugarmoiety
SD00003

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