Base information
| Cat. No. | |
| CAS No. | 125-02-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H27Na2O8P |
| Molecular Weight | 484.388 |
| Exact Mass | 484.124 |
| XLogP3 | 2.551 |
| Mr | 104.906 |
| PSA | 156.83 |
| Sequence | - |
| Atom number | 59 |
| Bond number | 60 |
| Ring number | 4 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=C1C=C[C@]2(C(=C1)CC[C@@H]1[C@@H]2[C@@H](O)C[C@]2([C@H]1CC[C@]2(O)C(=O)COP(=O)([O-])[O-])C)C.[Na+].[Na+] |
