Base information
| Cat. No. | |
| CAS No. | 121377-67-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C39H57N9O9 |
| Molecular Weight | 795.925 |
| Exact Mass | 795.428 |
| XLogP3 | 3.7799 |
| Mr | 210.946 |
| PSA | 290.59 |
| Sequence | - |
| Atom number | 114 |
| Bond number | 116 |
| Ring number | 3 |
| Rotor number | 28 |
| Residues number | 0 |
| Canonical smiles | CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)N)CC(C)C)CC(=O)O)C |