Base information
| Cat. No. | |
| CAS No. | 552-66-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H20O9 |
| Molecular Weight | 416.378 |
| Exact Mass | 416.111 |
| XLogP3 | 0.3443 |
| Mr | 104.088 |
| PSA | 149.82 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 53 |
| Ring number | 4 |
| Rotor number | 4 |
| 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]1O)O)O |
