Base information
| Cat. No. | |
| CAS No. | 125366-42-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C53H95N21O18 |
| Molecular Weight | 1314.45 |
| Exact Mass | 1313.72 |
| XLogP3 | -1.7278 |
| Mr | 326.485 |
| PSA | 671.32 |
| Sequence | - |
| Atom number | 187 |
| Bond number | 187 |
| Ring number | 1 |
| Rotor number | 59 |
| Residues number | 0 |
| Canonical smiles | NCCCC[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)N[C@H](C(=O)N[C@H](C(=O)O)CCCCN)CO)CCCNC(=N)N)CCC(=O)N)CO)CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)C)CO)CCC(=O)N |
