Base information
| Cat. No. | |
| CAS No. | 285978-18-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H13N2Na2O15P3 |
| Molecular Weight | 528.105 |
| Exact Mass | 527.932 |
| XLogP3 | -1.6245 |
| Mr | 83.9354 |
| PSA | 299.46 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 43 |
| Ring number | 2 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | O[C@@H]1[C@@H](COP(=O)(OP(=O)(OP(=O)(O)[O-])O)[O-])O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O.[Na+].[Na+] |
