Base information
| Cat. No. | |
| CAS No. | 2096980-79-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C64H108N18O24S |
| Molecular Weight | 1545.71 |
| Exact Mass | 1544.75 |
| XLogP3 | -1.5451 |
| Mr | 380.235 |
| PSA | 700.5 |
| Sequence | - |
| Atom number | 215 |
| Bond number | 215 |
| Ring number | 1 |
| Rotor number | 68 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)N)CCC(=O)O)CCC(=O)O)CO)CC(C)C)CCC(=O)N)CO)CCSC |
