Base information
| Cat. No. | |
| CAS No. | 170713-75-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C79H129N27O22 |
| Molecular Weight | 1809.04 |
| Exact Mass | 1807.98 |
| XLogP3 | 1.0768 |
| Mr | 457.416 |
| PSA | 831.4 |
| Sequence | - |
| Atom number | 257 |
| Bond number | 258 |
| Ring number | 2 |
| Rotor number | 80 |
| 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)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CC(=O)N)C)CC(C)C)CCCCN)CCCNC(=N)N)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)N)C)CCCNC(=N)N |
