Base information
| Cat. No. | |
| CAS No. | 122021-74-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C36H28MgO16 |
| Molecular Weight | 740.903 |
| Exact Mass | 740.123 |
| XLogP3 | 0.6651 |
| Mr | 174.184 |
| PSA | 283.7 |
| Sequence | - |
| Atom number | 81 |
| Bond number | 84 |
| Ring number | 5 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | O=C(OC(C(=O)[O-])Cc1ccc(c(c1)O)O)/C=C/c1ccc(c2c1C(C(=O)OC(C(=O)[O-])Cc1ccc(c(c1)O)O)C(O2)c1ccc(c(c1)O)O)O.[Mg+2] |
