Base information
| Cat. No. | |
| CAS No. | 2646-71-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H31N7NaO17P3 |
| Molecular Weight | 769.419 |
| Exact Mass | 769.089 |
| XLogP3 | -1.2375 |
| Mr | 157.268 |
| PSA | 393.58 |
| Sequence | - |
| Atom number | 80 |
| Bond number | 83 |
| 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)n1cnc2c1ncnc2N)O)O.[NaH] |
