Base information
| Cat. No. | |
| CAS No. | 117442-28-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C51H79N15O9 |
| Molecular Weight | 1046.27 |
| Exact Mass | 1045.62 |
| XLogP3 | 4.4004 |
| Mr | 288.459 |
| PSA | 381.83 |
| Sequence | - |
| Atom number | 154 |
| Bond number | 158 |
| Ring number | 5 |
| Rotor number | 37 |
| 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)O)CC(C)C)[C@H](CC)C)Cc1c[nH]c2c1cccc2)CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1nc[nH]c1)N |