Glycoside
GD021083
Name:
NoneFormula:
C13H12O6N6Smiles:
Nc1ncnc2c1c1c([O-])nc([O-])nc1n2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1-c1c([O-])nc([O-])nc1[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -3.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 348.28 | Num_heavy_atoms: | 25 |
| TPSA: | 198.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD14460
Formula: C8H3O2N6
Smiles:
Nc1ncnc2c1-c1c([O-])nc([O-])nc1[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -1.46 | Num_rotatable_bonds: | 0 |
| MolWt: | 215.15 | Num_heavy_atoms: | 16 |
| TPSA: | 137.8 | NumAromaticRings: | 2 |
