Base information
| Cat. No. | |
| CAS No. | 21082-33-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H18O7 |
| Molecular Weight | 286.278 |
| Exact Mass | 286.105 |
| XLogP3 | -1.1207 |
| Mr | 67.5762 |
| PSA | 119.61 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 39 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1OC(Oc2cc(C)cc(c2)O)[C@@H]([C@H]([C@@H]1O)O)O |
