Glycoside
GD142077
Name:
3β-O-β-D-GlucopyranosylcycloeucalenolFormula:
C36H60O6Smiles:
C=C(CCC(C)C1CCC2(C)C3CCC4C(C)C(OC5OC(CO)C(O)C(O)C5O)CCC45CC35CCC12C)C(C)CAglycone:
C=C(CCC(C)C1CCC2(C)C3CCC4C(C)C(O)CCC45CC35CCC12C)C(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.94 |
| AlogP: | 5.85 | Num_rotatable_bonds: | 8 |
| MolWt: | 588.87 | Num_heavy_atoms: | 42 |
| TPSA: | 99.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD53528
Formula: C30H50O
Smiles:
C=C(CCC(C)C1CCC2(C)C3CCC4C(C)C(O)CCC45CC35CCC12C)C(C)C| HBA: | 1 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.93 |
| AlogP: | 8.02 | Num_rotatable_bonds: | 5 |
| MolWt: | 426.73 | Num_heavy_atoms: | 31 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
