Base information
| Cat. No. | |
| CAS No. | 217082-60-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C69H108N22O16S |
| Molecular Weight | 1533.8 |
| Exact Mass | 1532.8 |
| XLogP3 | 1.7155 |
| Mr | 409.594 |
| PSA | 613.26 |
| Sequence | - |
| Atom number | 216 |
| Bond number | 221 |
| Ring number | 6 |
| Rotor number | 58 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1ccccc1)CCSC)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]1CCC(=O)N1)CCCNC(=N)N)CCCNC(=N)N)CC(C)C)CO)Cc1nc[nH]c1 |
