Base information
| Cat. No. | |
| CAS No. | 42934-87-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H25N6Na4O18P3 |
| Molecular Weight | 834.333 |
| Exact Mass | 834.003 |
| XLogP3 | -0.4673 |
| Mr | 148.448 |
| PSA | 398.85 |
| Sequence | - |
| Atom number | 77 |
| Bond number | 77 |
| Ring number | 5 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | O[C@@H]1[C@H](O)[C@H](O[C@H]1N1C=CCC(=C1)C(=O)N)COP(=O)(OP(=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)OP(=O)([O-])[O-])n1cnc2c1nc[nH]c2=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+] |
