Glycoside
GD012745
Name:
NoneFormula:
C13H19O5NSSmiles:
Nc1ccc(CS[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
Nc1ccc(CS)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -0.7 | Num_rotatable_bonds: | 4 |
| MolWt: | 301.36 | Num_heavy_atoms: | 20 |
| TPSA: | 116.17 | NumAromaticRings: | 1 |
Unique Aglycone
AD09576
Formula: C7H9NS
Smiles:
Nc1ccc(CS)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 139.22 | Num_heavy_atoms: | 9 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
