Base information
| Cat. No. | |
| CAS No. | 129970-93-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H17NO5S |
| Molecular Weight | 287.332 |
| Exact Mass | 287.083 |
| XLogP3 | -0.258 |
| Mr | 70.2206 |
| PSA | 141.47 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 37 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](Sc2ccc(cc2)N)[C@H]([C@H]([C@@H]1O)O)O |
