Glycoside
GD136720
Name:
23-O-Beta-D-Glucopyranosyl-25-MethyldolichosteroneFormula:
C35H58O10Smiles:
C=C(C(OC1OC(CO)C(O)C(O)C1O)C(O)C(C)C1CCC2C3CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C)C(C)(C)CAglycone:
C=C(C(O)C(O)C(C)C1CCC2C3CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C)C(C)(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.91 |
| AlogP: | 1.94 | Num_rotatable_bonds: | 7 |
| MolWt: | 638.84 | Num_heavy_atoms: | 45 |
| TPSA: | 177.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD55268
Formula: C29H48O5
Smiles:
C=C(C(O)C(O)C(C)C1CCC2C3CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C)C(C)(C)C| HBA: | 5 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 4.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 476.7 | Num_heavy_atoms: | 34 |
| TPSA: | 97.99 | NumAromaticRings: | 0 |
