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Omarigliptin-[13C6]

General Information
Catalog: BLP-001378
Molecular Formula: C11[13C]6H20F2N4O3S
Molecular Weight: 404.38
Chemical Structure
Omarigliptin-[13C6]
Description Omarigliptin-[13C6] is a labelled analogue of Omarigliptin. Omarigliptin is a potent and selective dipeptidyl peptidase 4 (DPP-4) inhibitor to be used as the treatment for type 2 diabetes.
Synonyms [13C6]-MK-3102
IUPAC Name (2R,3S,5R)-2-(2,5-difluoro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)-5-(2-methylsulfonyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)oxan-3-amine
Related CAS 1226781-44-7 (unlabelled)
Canonical SMILES CS(=O)(=O)N1C=C2CN(CC2=N1)C3CC(C(OC3)C4=C(C=CC(=C4)F)F)N
InChI InChI=1S/C17H20F2N4O3S/c1-27(24,25)23-7-10-6-22(8-16(10)21-23)12-5-15(20)17(26-9-12)13-4-11(18)2-3-14(13)19/h2-4,7,12,15,17H,5-6,8-9,20H2,1H3/t12-,15+,17-/m1/s1/i2+1,3+1,4+1,11+1,13+1,14+1
InChI Key MKMPWKUAHLTIBJ-JMGMQALMSA-N
Purity 98%; 99% atom 13C

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