Glycoside
GD029214
Name:
NoneFormula:
C14H21O5NSSmiles:
NCc1ccc(CS[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
NCc1ccc(CS)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.57 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 5 |
| MolWt: | 315.39 | Num_heavy_atoms: | 21 |
| TPSA: | 116.17 | NumAromaticRings: | 1 |
Unique Aglycone
AD19029
Formula: C8H11NS
Smiles:
NCc1ccc(CS)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.58 | Num_rotatable_bonds: | 2 |
| MolWt: | 153.25 | Num_heavy_atoms: | 10 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
