Base information
| Cat. No. | |
| CAS No. | 117405-51-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H20O9 |
| Molecular Weight | 356.325 |
| Exact Mass | 356.111 |
| XLogP3 | -1.0283 |
| Mr | 83.749 |
| PSA | 145.91 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 46 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](Oc2ccc(cc2OC)/C=C/C(=O)O)[C@@H]([C@H]([C@@H]1O)O)O |
