Glycoside
GD058261
Name:
NoneFormula:
C12H14O8N4Smiles:
O=C[C@H](Nc1ccc([N+](=O)[O-])c2nonc12)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1ccc([N+](=O)[O-])c2nonc12Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -1.81 | Num_rotatable_bonds: | 8 |
| MolWt: | 342.26 | Num_heavy_atoms: | 24 |
| TPSA: | 192.08 | NumAromaticRings: | 2 |
Unique Aglycone
AD12089
Formula: C6H4O3N4
Smiles:
Nc1ccc([N+](=O)[O-])c2nonc12| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.71 | Num_rotatable_bonds: | 1 |
| MolWt: | 180.12 | Num_heavy_atoms: | 13 |
| TPSA: | 108.08 | NumAromaticRings: | 2 |
