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(E)-(7S)-2-OXO-CLOPIDOGREL;DERIVATIZED-H1-METABOLITE
SpectraBase Compound ID 1kNGsUpjr2G
InChI InChI=1S/C19H21ClN2O4S/c1-26-19(25)18(14-5-2-3-6-15(14)20)22-9-7-16(27-10-4-8-21)13(12-22)11-17(23)24/h2-3,5-6,11,16,18H,4,7,9-10,12H2,1H3,(H,23,24)/b13-11+/t16?,18-/m0/s1
InChIKey QPDMEZXMRNYUBV-CCKGBEQASA-N
Mol Weight 408.9 g/mol
Molecular Formula C19H21ClN2O4S
Exact Mass 408.091056 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EiMLFCawOLC
Name (E)-(7S)-2-OXO-CLOPIDOGREL;DERIVATIZED-H1-METABOLITE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21ClN2O4S
InChI InChI=1S/C19H21ClN2O4S/c1-26-19(25)18(14-5-2-3-6-15(14)20)22-9-7-16(27-10-4-8-21)13(12-22)11-17(23)24/h2-3,5-6,11,16,18H,4,7,9-10,12H2,1H3,(H,23,24)/b13-11+/t16?,18-/m0/s1
InChIKey QPDMEZXMRNYUBV-CCKGBEQASA-N
Literature Reference Author J.M.PEREILLO,M.MAFTOUH,A.ANDRIEU,M.F.UZABIAGA,O.FEDELI,P.SAV I,M.PASCAL,J.M.HERBE
Literature Reference Citation DRUG.MET.DISP.,30,1288(2002)
Literature Reference DOI 10.1124/dmd.30.11.1288
Molecular Weight 408.900 g/mol
Source File Reference UWLU74311