Glycoside
GD067099
Name:
NoneFormula:
C13H17O9N3Smiles:
COC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
COC(=O)c1cc([N+](=O)[O-])cnc1NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 5 |
| MolWt: | 359.29 | Num_heavy_atoms: | 25 |
| TPSA: | 184.51 | NumAromaticRings: | 1 |
Unique Aglycone
AD32069
Formula: C7H7O4N3
Smiles:
COC(=O)c1cc([N+](=O)[O-])cnc1N| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 2 |
| MolWt: | 197.15 | Num_heavy_atoms: | 14 |
| TPSA: | 108.35 | NumAromaticRings: | 1 |
