Base information
| Cat. No. | |
| CAS No. | 688805-40-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C47H78N12O14 |
| Molecular Weight | 1035.19 |
| Exact Mass | 1034.58 |
| XLogP3 | 1.0267 |
| Mr | 266.745 |
| PSA | 443.15 |
| Sequence | - |
| Atom number | 151 |
| Bond number | 152 |
| Ring number | 2 |
| Rotor number | 41 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)N)Cc1ccc(cc1)O)CO)CO)CC(=O)N |
