Glycoside
GD001269
Name:
NoneFormula:
C15H17O4NCl2Smiles:
OC[C@@H]1O[C@H](CNCc2ccc(Cl)cc2Cl)[C@H](O)[C@H]1OAglycone:
CNCc1ccc(Cl)cc1ClSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 5 |
| MolWt: | 322.19 | Num_heavy_atoms: | 20 |
| TPSA: | 81.95 | NumAromaticRings: | 1 |
Unique Aglycone
AD01304
Formula: C10H9NCl2
Smiles:
CNCc1ccc(Cl)cc1Cl| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 2.71 | Num_rotatable_bonds: | 2 |
| MolWt: | 190.07 | Num_heavy_atoms: | 11 |
| TPSA: | 12.03 | NumAromaticRings: | 1 |
