Ketotifen Impurity 5

cas: 81759-45-7 — see every product listed under this CAS number, including other names

Ketotifen Impurity 5 (CAS 81759-45-7) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberULK0615
cas81759-45-7
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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properties

purityNo data
categoryChemicals
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

(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.

Identity
Molecular formulaC25H27NO7S
Molecular weight485.6 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
InChIKeyWLTPAELNPGRIGG-RXYUJSHFSA-N
SMILESC[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)