Base information
| Cat. No. | |
| CAS No. | 106372-55-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H23N3O9S |
| Molecular Weight | 457.455 |
| Exact Mass | 457.116 |
| XLogP3 | 1.4711 |
| Mr | 109.543 |
| PSA | 199.57 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 54 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | O=C1C=C(C)OS(=O)(=O)N1.COC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)N)Cc1ccccc1 |
