Products 81759-45-7
CAS 81759-45-7 is the registry number for Ketotifen Impurity 5. Offered by: Chemat Brand. Available pack sizes: on request.
(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[1-methyl-4-(8-oxo-6-thiatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaen-2-ylidene)piperidin-1-ium-1-yl]oxane-2-carboxylate (CAS 81759-45-7) is a chemical compound with the molecular formula C25H27NO7S and a molecular weight of 485.6 g/mol. IUPAC name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[1-methyl-4-(8-oxo-6-thiatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaen-2-ylidene)piperidin-1-ium-1-yl]oxane-2-carboxylate. InChIKey: WLTPAELNPGRIGG-RXYUJSHFSA-N.
| Molecular formula | C25H27NO7S |
|---|---|
| Molecular weight | 485.6 g/mol |
| IUPAC name | (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[1-methyl-4-(8-oxo-6-thiatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaen-2-ylidene)piperidin-1-ium-1-yl]oxane-2-carboxylate |
| InChIKey | WLTPAELNPGRIGG-RXYUJSHFSA-N |
| SMILES | C[N+]1(CCC(=C2C3=C(C(=O)CC4=CC=CC=C42)SC=C3)CC1)[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)[O-])O)O)O |
Computed by PubChem (NCBI)
Synonyms:
Ketotifen Impurity 32