Base information
| Cat. No. | |
| CAS No. | 796073-54-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C37H52ClN3O10S |
| Molecular Weight | 766.341 |
| Exact Mass | 765.306 |
| XLogP3 | 5.0068 |
| Mr | 206.86 |
| PSA | 195.27 |
| Sequence | - |
| Atom number | 104 |
| Bond number | 107 |
| Ring number | 4 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | CO[C@@H]1/C=C/C=C(\C)/Cc2cc(OC)c(c(c2)N(C(=O)C[C@@H]([C@]2([C@H]([C@@H]([C@@H]3C[C@@]1(O)NC(=O)O3)C)O2)C)OC(=O)[C@@H](N(C(=O)CCC(S)C)C)C)C)Cl |
