Glycoside
GD058149
Name:
NoneFormula:
C12H14O7N3ClSmiles:
O=[N+]([O-])c1cc(Cl)cnc1N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
Nc1ncc(Cl)cc1[N+](=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -1.15 | Num_rotatable_bonds: | 4 |
| MolWt: | 335.7 | Num_heavy_atoms: | 22 |
| TPSA: | 158.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD29114
Formula: C6H4O2N3Cl
Smiles:
Nc1ncc(Cl)cc1[N+](=O)[O-]| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.23 | Num_rotatable_bonds: | 1 |
| MolWt: | 173.56 | Num_heavy_atoms: | 11 |
| TPSA: | 82.05 | NumAromaticRings: | 1 |
