Base information
| Cat. No. | |
| CAS No. | 87590-89-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C43H64N12O11S2 |
| Molecular Weight | 989.172 |
| Exact Mass | 988.426 |
| XLogP3 | 1.89428 |
| Mr | 273.306 |
| PSA | 430.83 |
| Sequence | - |
| Atom number | 132 |
| Bond number | 134 |
| Ring number | 3 |
| Rotor number | 19 |
| Residues number | 0 |
| Canonical smiles | N#CC[C@@H]1NC(=O)[C@H](CCC(=O)N)NC(=O)C(NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)N)[C@H](CC)C |
