Glycoside
GD066450
Name:
NoneFormula:
C15H14O6N3ClSmiles:
O=C(Nc1nc2ccccc2nc1Cl)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
Nc1nc2ccccc2nc1ClSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 6 |
| MolWt: | 355.73 | Num_heavy_atoms: | 24 |
| TPSA: | 152.87 | NumAromaticRings: | 2 |
Unique Aglycone
AD31820
Formula: C9H6N3Cl
Smiles:
Nc1nc2ccccc2nc1Cl| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 0 |
| MolWt: | 179.61 | Num_heavy_atoms: | 12 |
| TPSA: | 51.8 | NumAromaticRings: | 2 |
