Base information
| Cat. No. | |
| CAS No. | 69856-17-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C105H180N32O26S |
| Molecular Weight | 2338.82 |
| Exact Mass | 2337.35 |
| XLogP3 | 6.3588 |
| Mr | 606.789 |
| PSA | 1030.26 |
| Sequence | - |
| Atom number | 344 |
| Bond number | 345 |
| Ring number | 2 |
| Rotor number | 102 |
| Residues number | 0 |
| Canonical smiles | NCCCC[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)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC(=O)N)CC(C)C)[C@H](CC)C)CO)CC(=O)N)CC(C)C)Cc1ccc(cc1)O)CCCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](Cc1ccc(cc1)O)N)CCCNC(=N)N)CC(C)C)CCCNC(=N)N)CCCCN)CCC(=O)N)CCSC)C |