Glycoside
GD061593
Name:
NoneFormula:
C13H17O7NSSmiles:
O=[N+]([O-])c1ccc(CS[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
O=[N+]([O-])c1ccc(CS)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 5 |
| MolWt: | 331.35 | Num_heavy_atoms: | 22 |
| TPSA: | 133.29 | NumAromaticRings: | 1 |
Unique Aglycone
AD30182
Formula: C7H7O2NS
Smiles:
O=[N+]([O-])c1ccc(CS)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 2 |
| MolWt: | 169.21 | Num_heavy_atoms: | 11 |
| TPSA: | 43.14 | NumAromaticRings: | 1 |
