Base information
| Cat. No. | |
| CAS No. | 125357-12-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C75H127N27O15 |
| Molecular Weight | 1646.98 |
| Exact Mass | 1646 |
| XLogP3 | 5.6816 |
| Mr | 440.161 |
| PSA | 723.6 |
| Sequence | - |
| Atom number | 244 |
| Bond number | 246 |
| Ring number | 3 |
| Rotor number | 72 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCCN)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccc(cc1)O)N)CC(C)C)CCCNC(=N)N)CCCNC(=N)N)CCCNC(=N)N)CCCNC(=N)N |
