Base information
| Cat. No. | |
| CAS No. | 137132-69-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C101H181N39O25 |
| Molecular Weight | 2341.76 |
| Exact Mass | 2340.41 |
| XLogP3 | 3.8802 |
| Mr | 610.721 |
| PSA | 1107.13 |
| Sequence | - |
| Atom number | 346 |
| Bond number | 348 |
| Ring number | 3 |
| Rotor number | 107 |
| 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)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@H](O)C)CCCCN)CC(C)C)CCCNC(=N)N)CCCCN)CCCNC(=N)N)CCCCN)CCCNC(=N)N)CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1ccc(cc1)O)N)CCCNC(=N)N)CCCNC(=N)N)CCC(=O)O)CO |