Base information
| Cat. No. | |
| CAS No. | 4816-80-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H15NO6S |
| Molecular Weight | 301.316 |
| Exact Mass | 301.062 |
| XLogP3 | 2.063 |
| Mr | 70.0753 |
| PSA | 129.15 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 35 |
| Ring number | 1 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | OC(=O)[C@@H](NS(=O)(=O)c1ccc(cc1)C)CCC(=O)O |
