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Canagliflozin-[13C6]

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General Information
Catalog: BLP-000996
Molecular Formula: C18[13C]6H25FO5S
Molecular Weight: 450.47

Chemical Structure

Description	Canagliflozin-[13C6] is the labelled analogue of Canagliflozin. Canagliflozin is a sodium/glucose cotransporter 2 (SGLT2) inhibitor. Canagliflozin has been shown to dose dependently reduce calculated renal threshold for glucose excretion and increase urinary glucose excretion. Canagliflozin is a candidate for the treatment of type 2 diabetes and obesity.
Synonyms	[13C6]-Canagliflozin; (1S)-1,5-Anhydro-1-C-[3-[[5-(4-fluorophenyl-13C6)-2-thienyl]methyl]-4-methylphenyl]-D-glucitol; Canagliflozin-(fluorophenyl)-13C6
IUPAC Name	(2S,3R,4R,5S,6R)-2-[3-[[5-(4-fluoro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)thiophen-2-yl]methyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
Related CAS	842133-18-0 (unlabelled)
Canonical SMILES	CC1=C(C=C(C=C1)C2C(C(C(C(O2)CO)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F
InChI	InChI=1S/C24H25FO5S/c1-13-2-3-15(24-23(29)22(28)21(27)19(12-26)30-24)10-16(13)11-18-8-9-20(31-18)14-4-6-17(25)7-5-14/h2-10,19,21-24,26-29H,11-12H2,1H3/t19-,21-,22+,23-,24+/m1/s1/i4+1,5+1,6+1,7+1,14+1,17+1
InChI Key	XTNGUQKDFGDXSJ-JKBPOTIISA-N
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance	Light Yellow Solid
Storage	Store at -20°C