Base information
| Cat. No. | |
| CAS No. | 2611-67-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C27H31ClO16 |
| Molecular Weight | 646.978 |
| Exact Mass | 646.13 |
| XLogP3 | -5.1409 |
| Mr | 146.269 |
| PSA | 272.59 |
| Sequence | - |
| Atom number | 75 |
| Bond number | 78 |
| Ring number | 5 |
| Rotor number | 7 |
| 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)c2ccc(c(c2)O)O)[C@@H]([C@H]([C@@H]1O)O)O.[Cl-] |
