Glycoside
...
GD139577

Name:
Castasterone 23-O-Alpha-D-Glucoside

Formula:
C34H58O10

Smiles:
CC(C)C(C)C(OC1OC(CO)C(O)C(O)C1O)C(O)C(C)C1CCC2C3CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C

Aglycone:
CC(C)C(C)C(O)C(O)C(C)C1CCC2C3CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C

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

Other Identifiers

Properties
HBA: 10 RingCount: 5
HBD: 7 FractionCSP3: 0.97
AlogP: 1.63 Num_rotatable_bonds: 8
MolWt: 626.83 Num_heavy_atoms: 44
TPSA: 177.14 NumAromaticRings: 0

Unique Aglycone
AD56284
Formula: C28H48O5

Smiles:
CC(C)C(C)C(O)C(O)C(C)C1CCC2C3CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C
HBA: 5 RingCount: 4
HBD: 4 FractionCSP3: 0.96
AlogP: 3.81 Num_rotatable_bonds: 5
MolWt: 464.69 Num_heavy_atoms: 33
TPSA: 97.99 NumAromaticRings: 0

Sugarmoiety
SD00003

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