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Prasugrel Thiolactone-[13C6] hydrochloride

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General Information
Catalog: BLP-006530
Molecular Formula: C12[13C]6H18FNO2S.HCl
Molecular Weight: 373.82

Chemical Structure

Description	Prasugrel Thiolactone-[13C6] hydrochloride is the labelled salt of Prasugrel Thiolactone, which is an inactive metabolite of Prasugrel.
Synonyms	[13C6]-Desacetylprasugrel hydrochloride salt; R95913-13C6 hydrochloride; 5-(alpha-cyclopropylcarbonyl-2-fluorobenzyl)-2-oxo-2,4,5,6,7,7a-hexahydrothieno[3,2-c]pyridine-13C6 hydrochloride; 5-(2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl)-5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one-13C6 hydrochloride; Prasugrel EP Impurity D-13C6 hydrochloride; Prasugrel Thiolactone-13C6 hydrochloride
IUPAC Name	5-[2-cyclopropyl-1-(6-fluoro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)-2-oxoethyl]-4,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2-one;hydrochloride
Related CAS	150322-39-7 (unlabelled) 150322-38-6 (unlabelled free base)
Canonical SMILES	C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC4C(=CC(=O)S4)C3.Cl
InChI	InChI=1S/C18H18FNO2S.ClH/c19-14-4-2-1-3-13(14)17(18(22)11-5-6-11)20-8-7-15-12(10-20)9-16(21)23-15;/h1-4,9,11,15,17H,5-8,10H2;1H/i1+1,2+1,3+1,4+1,13+1,14+1;
InChI Key	GNCJDUATSSIGHD-JHRZJDGOSA-N
Purity	≥98%; ≥99% atom 13C
Solubility	Slightly soluble in Chloroform, Methanol
Appearance	White to Yellow Solid
Storage	Store at -20°C