Base information
| Cat. No. | |
| CAS No. | 100930-04-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C37H57N11O11S |
| Molecular Weight | 863.981 |
| Exact Mass | 863.396 |
| XLogP3 | 1.4286 |
| Mr | 219.975 |
| PSA | 398.44 |
| Sequence | - |
| Atom number | 117 |
| Bond number | 118 |
| Ring number | 2 |
| Rotor number | 34 |
| 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)NCC(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)CCCNC(=N)N)C(C)C)CCC(=O)O)NC(=O)[C@H](CO)N |