Base information
| Cat. No. | |
| CAS No. | 155114-45-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C57H94N18O18 |
| Molecular Weight | 1319.47 |
| Exact Mass | 1318.7 |
| XLogP3 | 0.738 |
| Mr | 333.363 |
| PSA | 568.91 |
| Sequence | - |
| Atom number | 187 |
| Bond number | 188 |
| Ring number | 2 |
| Rotor number | 54 |
| Residues number | 0 |
| Canonical smiles | NCC(=O)N[C@H](C(=O)NCC(=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)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(C)C)C)C(C)C)CC(C)C)CC(C)C)CC(=O)O)Cc1nc[nH]c1)CCCNC(=N)N)CC(=O)O |
