Base information
| Cat. No. | |
| CAS No. | 101233-12-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C86H137N25O25 |
| Molecular Weight | 1921.16 |
| Exact Mass | 1920.02 |
| XLogP3 | -0.21 |
| Mr | 485.969 |
| PSA | 826.12 |
| Sequence | - |
| Atom number | 273 |
| Bond number | 275 |
| Ring number | 3 |
| Rotor number | 79 |
| 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)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1ccccc1)C)CCCCN)CO)C(C)C)CC(=O)N)[C@H](O)C)C(C)C)Cc1ccccc1)CC(=O)N)CC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)CNC(=O)[C@H](CO)N |