Glycoside
GD026549
Name:
NoneFormula:
C13H15O10N3Smiles:
O=C(N[C@@H]1C(O)O[C@H](CO)[C@H](O)[C@H]1O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Aglycone:
NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -1.97 | Num_rotatable_bonds: | 5 |
| MolWt: | 373.27 | Num_heavy_atoms: | 26 |
| TPSA: | 205.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD12050
Formula: C7H5O5N3
Smiles:
NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1| HBA: | 8 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.6 | Num_rotatable_bonds: | 3 |
| MolWt: | 211.13 | Num_heavy_atoms: | 15 |
| TPSA: | 129.37 | NumAromaticRings: | 1 |
