Base information
| Cat. No. | |
| CAS No. | 16727-30-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C29H35ClO17 |
| Molecular Weight | 691.031 |
| Exact Mass | 690.156 |
| XLogP3 | -4.8293 |
| Mr | 157.23 |
| PSA | 270.82 |
| Sequence | - |
| Atom number | 82 |
| Bond number | 85 |
| Ring number | 5 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](Oc2cc(O)cc3c2cc(O[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)c([o+]3)c2cc(OC)c(c(c2)OC)O)[C@@H]([C@H]([C@@H]1O)O)O.[Cl-] |