Base information
| Cat. No. | |
| CAS No. | 29907-19-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H21ClO11 |
| Molecular Weight | 484.838 |
| Exact Mass | 484.077 |
| XLogP3 | -1.8808 |
| Mr | 115.008 |
| PSA | 193.44 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Oc1cc(O)c2c(c1)[o+]c(c(c2)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)c1cc(O)c(c(c1)O)O.[Cl-] |
