Base information
| Cat. No. | |
| CAS No. | 75921-69-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C78H111N21O19 |
| Molecular Weight | 1646.85 |
| Exact Mass | 1645.84 |
| XLogP3 | 3.1205 |
| Mr | 430.2 |
| PSA | 642.98 |
| Sequence | - |
| Atom number | 229 |
| Bond number | 234 |
| Ring number | 6 |
| Rotor number | 64 |
| Residues number | 0 |
| Canonical smiles | CCCC[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)N)C(C)C)CCCCN)Cc1c[nH]c2c1cccc2)CCCNC(=N)N)Cc1ccccc1)Cc1nc[nH]c1)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CO)Cc1ccc(cc1)O)CO |
