Base information
| Cat. No. | |
| CAS No. | 159768-75-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C49H75N15O12S |
| Molecular Weight | 1098.28 |
| Exact Mass | 1097.54 |
| XLogP3 | 0.7956 |
| Mr | 292.625 |
| PSA | 454.41 |
| Sequence | - |
| Atom number | 152 |
| Bond number | 156 |
| Ring number | 5 |
| Rotor number | 38 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1cccs1)NC(=O)CNC(=O)[C@@H]1C[C@H](CN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N)O)CO)CN[C@H](C(=O)O)CCCNC(=N)N |
