Base information
| Cat. No. | |
| CAS No. | 639089-97-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H18O12 |
| Molecular Weight | 462.36 |
| Exact Mass | 462.08 |
| XLogP3 | 0.1165 |
| Mr | 110.739 |
| PSA | 189.26 |
| Sequence | - |
| Atom number | 51 |
| Bond number | 55 |
| Ring number | 5 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1c(O[C@@H]2O[C@@H](C)[C@@H]([C@H]([C@H]2O)O)O)cc2c3c1oc(=O)c1c3c(oc2=O)c(c(c1)O)O |
