Glycoside
GD000199
Name:
NoneFormula:
C12H13O5N4ClSmiles:
OC[C@@H]1OC(n2cnc3c(NO)cc(Cl)nc32)[C@H](O)[C@H]1OAglycone:
ONc1cc(Cl)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 316.7 | Num_heavy_atoms: | 21 |
| TPSA: | 132.89 | NumAromaticRings: | 2 |
Unique Aglycone
AD00235
Formula: C7H4ON4Cl
Smiles:
ONc1cc(Cl)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.45 | Num_rotatable_bonds: | 1 |
| MolWt: | 183.58 | Num_heavy_atoms: | 12 |
| TPSA: | 71.61 | NumAromaticRings: | 1 |
