Glycoside
GD021178
Name:
NoneFormula:
C12H14O6N4Smiles:
C[C@@H]1O[C@H](c2nc3c([N+](=O)[O-])cccn3n2)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=[N+]([O-])c1cccn2ncnc12Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 2 |
| MolWt: | 310.27 | Num_heavy_atoms: | 22 |
| TPSA: | 143.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD04574
Formula: C6H4O2N4
Smiles:
O=[N+]([O-])c1cccn2ncnc12| HBA: | 6 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 0.64 | Num_rotatable_bonds: | 1 |
| MolWt: | 164.12 | Num_heavy_atoms: | 12 |
| TPSA: | 73.33 | NumAromaticRings: | 2 |
