Glycoside
GD044352
Name:
NoneFormula:
C11H15O4N2SSmiles:
NC(=S)c1ccc[n+]([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
NC(=S)c1ccc[nH+]c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -1.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 271.32 | Num_heavy_atoms: | 18 |
| TPSA: | 99.82 | NumAromaticRings: | 1 |
Unique Aglycone
AD00494
Formula: C6H7N2S
Smiles:
NC(=S)c1ccc[nH+]c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 139.2 | Num_heavy_atoms: | 9 |
| TPSA: | 40.16 | NumAromaticRings: | 1 |
