Base information
| Cat. No. | |
| CAS No. | 76343-93-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H31NO5S |
| Molecular Weight | 421.55 |
| Exact Mass | 421.192 |
| XLogP3 | 4.1884 |
| Mr | 118.571 |
| PSA | 110.16 |
| Sequence | - |
| Atom number | 60 |
| Bond number | 62 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=C1SC[C@H](N1)[C@@]1(O)C[C@H]2C[C@H](O1)CC[C@H](C)/C=C\C=C\CC/C(=C\C(=O)O2)/C |
