Base information
| Cat. No. | |
| CAS No. | 1195968-02-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H22O9 |
| Molecular Weight | 430.405 |
| Exact Mass | 430.126 |
| XLogP3 | 0.9984 |
| Mr | 108.818 |
| PSA | 138.82 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](Oc2ccc3c(c2)occ(c3=O)c2ccc(cc2)O)[C@@H]([C@H]([C@@H]1OC)O)O |
