Base information
| Cat. No. | |
| CAS No. | 69712-56-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H17N7O8S4 |
| Molecular Weight | 575.619 |
| Exact Mass | 575.002 |
| XLogP3 | -0.3684 |
| Mr | 131.168 |
| PSA | 321.13 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | CO[C@@]1(NC(=O)C2S/C(=C(\C(=O)O)/C(=O)N)/S2)C(=O)N2[C@@H]1SCC(=C2C(=O)O)CSc1nnnn1C |
