Base information
| Cat. No. | |
| CAS No. | 293735-04-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C142H237N43O40 |
| Molecular Weight | 3186.67 |
| Exact Mass | 3184.78 |
| XLogP3 | 3.614 |
| Mr | 821.442 |
| PSA | 1358.2 |
| Sequence | - |
| Atom number | 462 |
| Bond number | 467 |
| Ring number | 6 |
| Rotor number | 140 |
| 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)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)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CCCNC(=N)N)CCC(=O)N)CC(C)C)CCCCN)C)CCCCN)CCCCN)CO)CCC(=O)O)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]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CN)CO)COC(=O)CCCCCCC)Cc1ccccc1)CC(C)C)CO)CCC(=O)O)Cc1[nH]cnc1)CCC(=O)N)CCCCN)C)CCC(=O)N)CCCNC(=N)N |