Base information
| Cat. No. | |
| CAS No. | 21705-02-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C39H53N9O14S |
| Molecular Weight | 903.955 |
| Exact Mass | 903.343 |
| XLogP3 | -1.1881 |
| Mr | 250.28 |
| PSA | 374.07 |
| Sequence | - |
| Atom number | 116 |
| Bond number | 120 |
| Ring number | 5 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCC([C@@H]1NC(=O)CNC(=O)[C@H]2NC(=O)[C@@H](NC(=O)C3N(C(=O)[C@@H](NC(=O)[C@H](NC(=O)CNC1=O)CS(=O)c1c(C2)c2ccc(cc2[nH]1)O)CC(=O)O)CC(C3)O)[C@H]([C@@H](O)C)C)C |
