Base information
| Cat. No. | |
| CAS No. | 120814-48-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C55H77N13O14S2 |
| Molecular Weight | 1208.41 |
| Exact Mass | 1207.52 |
| XLogP3 | 2.7184 |
| Mr | 313.252 |
| PSA | 476.1 |
| Sequence | - |
| Atom number | 161 |
| Bond number | 164 |
| Ring number | 4 |
| Rotor number | 45 |
| Residues number | 0 |
| Canonical smiles | CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCSC)CC(C)C)Cc1ccccc1)Cc1ccccc1)CC(=O)O)Cc1nc[nH]c1)NC(=O)[C@H](CC(=O)O)N |
