Glycoside
GD058325
Name:
NoneFormula:
C13H17O8N3Smiles:
COC(=O)[C@@H](NNc1ccccc1[N+](=O)[O-])C(=O)[C@H](O)[C@H](O)COAglycone:
COC(=O)CNNc1ccccc1[N+](=O)[O-]Sugarmoiety:
O=C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -1.66 | Num_rotatable_bonds: | 9 |
| MolWt: | 343.29 | Num_heavy_atoms: | 24 |
| TPSA: | 171.26 | NumAromaticRings: | 1 |
Unique Aglycone
AD29173
Formula: C9H11O4N3
Smiles:
COC(=O)CNNc1ccccc1[N+](=O)[O-]| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 5 |
| MolWt: | 225.2 | Num_heavy_atoms: | 16 |
| TPSA: | 93.5 | NumAromaticRings: | 1 |
