Base information
| Cat. No. | |
| CAS No. | 101705-37-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H22O8 |
| Molecular Weight | 342.341 |
| Exact Mass | 342.131 |
| XLogP3 | -0.9075 |
| Mr | 82.1972 |
| PSA | 136.68 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 47 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](Oc2cc(CCC(=O)C)ccc2O)[C@@H]([C@H]([C@@H]1O)O)O |
