Base information
| Cat. No. | |
| CAS No. | 3681-99-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H20O9 |
| Molecular Weight | 416.378 |
| Exact Mass | 416.111 |
| XLogP3 | 0.3861 |
| Mr | 104.585 |
| PSA | 160.82 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 53 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)c1c(O)ccc2c1occ(c2=O)c1ccc(cc1)O |
