Glycoside
GD014012
Name:
NoneFormula:
C10H12O6N6Smiles:
Nc1nc([N+](=O)[O-])nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc([N+](=O)[O-])nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -2.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 312.24 | Num_heavy_atoms: | 22 |
| TPSA: | 182.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD10378
Formula: C5H3O2N6
Smiles:
Nc1nc([N+](=O)[O-])nc2c1N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 1 |
| MolWt: | 179.12 | Num_heavy_atoms: | 13 |
| TPSA: | 121.4 | NumAromaticRings: | 1 |
