Canagliflozin Impurity 86

cas: 1672658-93-3 — see every product listed under this CAS number, including other names

Canagliflozin Impurity 86 (CAS 1672658-93-3) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-C182586
cas1672658-93-3
sizeon request
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Structural formula: {0} (CAS {1})

(3R,4S,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-2,3,4,5-tetrol (CAS 1672658-93-3) is a chemical compound with the molecular formula C24H25FO6S and a molecular weight of 460.5 g/mol. IUPAC name: (3R,4S,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-2,3,4,5-tetrol. InChIKey: MKOMVMKJXCXABB-KKEQRHKBSA-N.

Identity
Molecular formulaC24H25FO6S
Molecular weight460.5 g/mol
IUPAC name(3R,4S,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-2,3,4,5-tetrol
InChIKeyMKOMVMKJXCXABB-KKEQRHKBSA-N
SMILESCC1=C(C=C(C=C1)C2([C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F

Computed by PubChem (NCBI)

Synonyms: Canagliflozin Impurity37, 1-C-[3-[[5-(4-Fluorophenyl)-2-thienyl]methyl]-4-methylphenyl]-D-glucopyranose, D-Glucopyranose, 1-C-[3-[[5-(4-fluorophenyl)-2-thienyl]methyl]-4-methylphenyl]-
Isomers (same molecular formula)
(2R,3S,4R,5R)-1-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-2,3,4,5,6-pentahydroxyhexan-1-one C24H25FO6S
(2S,3R,4R,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]-hydroxymethyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-3,4,5-triol C24H25FO6S

Also listed as

Canagliflozin Impurity 10 Chemat Brand CAS 1672658-93-3
(3R,4S,5S,6R)-2-(3-((5-(4-Fluorophenyl)thiophen-2-yl)methyl)-4-methylphenyl)-6-(hydroxymethyl)tetrahydro-2H-pyran-2,3,4,5-tetraol, 95% Chemat Brand CAS 1672658-93-3