Base information
| Cat. No. | |
| CAS No. | 100930-11-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C80H109N21O13S |
| Molecular Weight | 1604.92 |
| Exact Mass | 1603.82 |
| XLogP3 | 8.4388 |
| Mr | 438.722 |
| PSA | 598.09 |
| Sequence | - |
| Atom number | 224 |
| Bond number | 231 |
| Ring number | 8 |
| Rotor number | 58 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCSC)CC(C)C)Cc1c[nH]c2c1cccc2)Cc1ccccc1)Cc1c[nH]c2c1cccc2)CCC(=O)N)CCC(=O)N)NC(=O)[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](CCCNC(=N)N)N |