Base information
| Cat. No. | |
| CAS No. | 27761-19-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H13NO6S |
| Molecular Weight | 227.236 |
| Exact Mass | 227.046 |
| XLogP3 | -1.5474 |
| Mr | 49.5736 |
| PSA | 179.88 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 25 |
| Ring number | 0 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O[C@H]([C@H](C(=O)O)O)C(=O)O.NCCS |
