Glycoside
GD048072
Name:
NoneFormula:
C11H12O6N3ClSmiles:
O=C(Nc1ccc(Cl)nn1)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
Nc1ccc(Cl)nn1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -2.29 | Num_rotatable_bonds: | 6 |
| MolWt: | 305.67 | Num_heavy_atoms: | 20 |
| TPSA: | 152.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD25804
Formula: C5H4N3Cl
Smiles:
Nc1ccc(Cl)nn1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.71 | Num_rotatable_bonds: | 0 |
| MolWt: | 129.55 | Num_heavy_atoms: | 8 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
