Glycoside
GD069431
Name:
NoneFormula:
C13H10O6N3Cl3Smiles:
O=C(Nc1nc(Cl)c(Cl)nc1Cl)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
Nc1nc(Cl)c(Cl)nc1ClSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 6 |
| MolWt: | 374.56 | Num_heavy_atoms: | 22 |
| TPSA: | 152.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD32952
Formula: C7H2N3Cl3
Smiles:
Nc1nc(Cl)c(Cl)nc1Cl| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 0 |
| MolWt: | 198.44 | Num_heavy_atoms: | 10 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
