Base information
| Cat. No. | |
| CAS No. | 6820-54-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C26H21NaO10 |
| Molecular Weight | 516.429 |
| Exact Mass | 516.103 |
| XLogP3 | 0.8406 |
| Mr | 120.33 |
| PSA | 173.65 |
| Sequence | - |
| Atom number | 58 |
| Bond number | 60 |
| Ring number | 4 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | O=C[C@@H]([C@H]([C@@H]([C@@H](C(=O)Oc1ccc(cc1)C1(OC(=O)c2c1cccc2)c1ccc(cc1)[O-])O)O)O)O.[Na+] |
