Glycoside
GD069477
Name:
NoneFormula:
C16H17O6NCl2Smiles:
Cc1cc(Cl)cc(Cl)c1CNC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
Cc1cc(Cl)cc(Cl)c1CNSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -0.44 | Num_rotatable_bonds: | 7 |
| MolWt: | 366.2 | Num_heavy_atoms: | 23 |
| TPSA: | 127.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD32961
Formula: C10H9NCl2
Smiles:
Cc1cc(Cl)cc(Cl)c1CN| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 2.76 | Num_rotatable_bonds: | 1 |
| MolWt: | 190.07 | Num_heavy_atoms: | 11 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
