Base information
| Cat. No. | |
| CAS No. | 80714-61-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C37H51N9O10S |
| Molecular Weight | 813.92 |
| Exact Mass | 813.348 |
| XLogP3 | 0.917 |
| Mr | 213.473 |
| PSA | 311.62 |
| Sequence | - |
| Atom number | 108 |
| Bond number | 111 |
| Ring number | 4 |
| Rotor number | 27 |
| Residues number | 0 |
| Canonical smiles | CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC[C@H]1C(=O)O)Cc1ccccc1)Cc1nc[nH]c1)CCC(=O)O)N |
