Glycoside
GD011808
Name:
NoneFormula:
C12H11O6N4ClSmiles:
O=[N+]([O-])c1cc(Cl)nc2c1ncn2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
O=[N+]([O-])c1cc(Cl)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | -0.4 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.68 | Num_heavy_atoms: | 22 |
| TPSA: | 143.77 | NumAromaticRings: | 2 |
Unique Aglycone
AD08973
Formula: C7H2O2N4Cl
Smiles:
O=[N+]([O-])c1cc(Cl)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 1 |
| MolWt: | 197.56 | Num_heavy_atoms: | 13 |
| TPSA: | 82.49 | NumAromaticRings: | 1 |
