Base information
| Cat. No. | |
| CAS No. | 141702-36-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H19NO8S |
| Molecular Weight | 397.4 |
| Exact Mass | 397.083 |
| XLogP3 | 0.825 |
| Mr | 96.1778 |
| PSA | 144.72 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 49 |
| Ring number | 4 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | C[C@H]([C@H]1C(=O)N2[C@@H]1SC(=C2C(=O)OCc1oc(=O)oc1C)[C@H]1CCCO1)O |
