Base information
| Cat. No. | |
| CAS No. | 524943-91-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H21ClO10+ |
| Molecular Weight | 468.838 |
| Exact Mass | 468.082 |
| XLogP3 | 1.1378 |
| Mr | 110.369 |
| PSA | 158.3 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1O)C1=[C+](Cc2c(O1)cc(O)cc2O)O[C@@]1(Cl)OC[C@@H]([C@@H]([C@H]1O)O)O |
