Base information
| Cat. No. | |
| CAS No. | 137181-56-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C85H144N26O28S |
| Molecular Weight | 2010.28 |
| Exact Mass | 2009.04 |
| XLogP3 | -1.1842 |
| Mr | 511.455 |
| PSA | 909.59 |
| Sequence | - |
| Atom number | 284 |
| Bond number | 287 |
| Ring number | 4 |
| Rotor number | 82 |
| Residues number | 0 |
| Canonical smiles | NCCCC[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)O)CC(=O)O)[C@H](O)C)CCC(=O)N)CCSC)CCCCN)CC(=O)O)CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](N)C)CCC(=O)N)CO)CCCCN)CO |