Base information
| Cat. No. | |
| CAS No. | 261969-04-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C68H104N14O13S |
| Molecular Weight | 1357.7 |
| Exact Mass | 1356.76 |
| XLogP3 | 6.7579 |
| Mr | 366.429 |
| PSA | 460.76 |
| Sequence | - |
| Atom number | 200 |
| Bond number | 202 |
| Ring number | 3 |
| Rotor number | 55 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)C(C)C)CCSC)C(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)N)CCCCN)Cc1ccccc1 |
