Base information
| Cat. No. | |
| CAS No. | 53797-35-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H36N4O14S |
| Molecular Weight | 552.551 |
| Exact Mass | 552.195 |
| XLogP3 | -3.4231 |
| Mr | 113.853 |
| PSA | 345.36 |
| Sequence | - |
| Atom number | 72 |
| Bond number | 73 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | OS(=O)(=O)O.OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)O[C@H]1[C@H](O[C@H]2O[C@H](CN)[C@H]([C@@H]([C@H]2N)O)O)[C@@H](N)C[C@H]([C@@H]1O)N |
