Base information
| Cat. No. | |
| CAS No. | 15674-58-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C27H31ClO16 |
| Molecular Weight | 646.978 |
| Exact Mass | 646.13 |
| XLogP3 | -4.0566 |
| Mr | 147.392 |
| PSA | 272.59 |
| Sequence | - |
| Atom number | 75 |
| Bond number | 78 |
| Ring number | 5 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | Oc1cc(O)c2c(c1)[o+]c(c(c2)O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@@H]([C@H]([C@H]2O)O)O)[C@H]([C@@H]([C@H]1O)O)O)c1cc(O)c(c(c1)O)O.[Cl-] |
