Base information
| Cat. No. | |
| CAS No. | 117107-54-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C49H67N13O15 |
| Molecular Weight | 1078.13 |
| Exact Mass | 1077.49 |
| XLogP3 | -1.1226 |
| Mr | 272.308 |
| PSA | 453.66 |
| Sequence | - |
| Atom number | 144 |
| Bond number | 147 |
| Ring number | 4 |
| Rotor number | 39 |
| Residues number | 0 |
| Canonical smiles | OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N)CC(=O)N)Cc1c[nH]c2c1cccc2)CO)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1)CC(C)C)Cc1ccccc1 |