Base information
| Cat. No. | |
| CAS No. | 148067-21-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C124H205N39O39S2 |
| Molecular Weight | 2930.32 |
| Exact Mass | 2928.47 |
| XLogP3 | 1.9721 |
| Mr | 744.412 |
| PSA | 1329.62 |
| Sequence | - |
| Atom number | 409 |
| Bond number | 412 |
| Ring number | 4 |
| Rotor number | 125 |
| Residues number | 0 |
| Canonical smiles | NCCCC[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)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=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)N1CCC[C@H]1C(=O)O)CCSC)C)CC(=O)O)CCCNC(=N)N)CCCNC(=N)N)CCSC)CCCNC(=N)N)CCC(=O)O)CC(=O)N)[C@H](CC)C)CCCNC(=N)N)CC(=O)O)CC(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]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)N)CO)Cc1ccccc1)CCC(=O)O)CCC(=O)O)C |