Base information
| Cat. No. | |
| CAS No. | 531-44-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H18O9 |
| Molecular Weight | 354.309 |
| Exact Mass | 354.095 |
| XLogP3 | -1.0197 |
| Mr | 83.1212 |
| PSA | 138.82 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 45 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](Oc2cc3oc(=O)ccc3cc2OC)[C@@H]([C@H]([C@@H]1O)O)O |
