Glycoside
GD075919
Name:
NoneFormula:
C12H15O7N4ClSSmiles:
CSc1nc(Cl)c([N+](=O)[O-])c(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)n1Aglycone:
CSc1nc(N)c([N+](=O)[O-])c(Cl)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -1.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 382.78 | Num_heavy_atoms: | 24 |
| TPSA: | 171.1 | NumAromaticRings: | 1 |
Unique Aglycone
AD35137
Formula: C6H5O2N4ClS
Smiles:
CSc1nc(N)c([N+](=O)[O-])c(Cl)n1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 220.64 | Num_heavy_atoms: | 13 |
| TPSA: | 94.94 | NumAromaticRings: | 1 |
