Glycoside
GD012414
Name:
NoneFormula:
C25H30O5NClSmiles:
CN(C)c1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCC3)cc1Aglycone:
CN(C)c1ccc(Cc2ccc3c(c2Cl)CCC3)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 2.0 | Num_rotatable_bonds: | 5 |
| MolWt: | 447.96 | Num_heavy_atoms: | 31 |
| TPSA: | 93.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD09365
Formula: C19H20NCl
Smiles:
CN(C)c1ccc(Cc2ccc3c(c2Cl)CCC3)cc1| HBA: | 1 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 4.49 | Num_rotatable_bonds: | 3 |
| MolWt: | 285.82 | Num_heavy_atoms: | 20 |
| TPSA: | 3.24 | NumAromaticRings: | 2 |
