Base information
| Cat. No. | |
| CAS No. | 20299-15-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H16N2O7S |
| Molecular Weight | 332.33 |
| Exact Mass | 332.068 |
| XLogP3 | -1.7671 |
| Mr | 74.6981 |
| PSA | 166.1 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 39 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cc(CC(=O)OC)c(=O)[nH]c1=S |
