Base information
| Cat. No. | |
| CAS No. | 207572-67-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H10N3Na4O12PS2 |
| Molecular Weight | 599.305 |
| Exact Mass | 598.903 |
| XLogP3 | 3.779 |
| Mr | 97.2198 |
| PSA | 288.3 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 43 |
| Ring number | 2 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | O=Cc1c(COP(=O)([O-])[O-])c(/N=N/c2cc(ccc2S(=O)(=O)[O-])S(=O)(=O)[O-])nc(c1O)C.[Na+].[Na+].[Na+].[Na+] |
