Base information
| Cat. No. | |
| CAS No. | 119478-56-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H27N3O6S |
| Molecular Weight | 401.478 |
| Exact Mass | 401.162 |
| XLogP3 | -0.1056 |
| Mr | 107.413 |
| PSA | 144.71 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 55 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | C[C@H]([C@H]1C(=O)N2[C@@H]1[C@@H](C)C(=C2C(=O)O)S[C@@H]1CN[C@@H](C1)C(=O)N(C)C)O.O |
