Base information
| Cat. No. | |
| CAS No. | 125401-92-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H17N4NaO8 |
| Molecular Weight | 452.35 |
| Exact Mass | 452.094 |
| XLogP3 | 1.2491 |
| Mr | 101.639 |
| PSA | 147.07 |
| Sequence | - |
| Atom number | 49 |
| Bond number | 50 |
| Ring number | 3 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | COc1nc(Oc2cccc(c2C(=O)[O-])Oc2nc(OC)cc(n2)OC)nc(c1)OC.[Na+] |
