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GLYCYL-(S-PALMITOYL)-L-CYSTEINE-ALLYLESTER-HYDROTRIFLUOROACETATE;HGLYCYS(PAL)OALL*TFA

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GLYCYL-(S-PALMITOYL)-L-CYSTEINE-ALLYLESTER-HYDROTRIFLUOROACETATE;HGLYCYS(PAL)OALL*TFA
SpectraBase Compound ID GzAtODdagRv
InChI InChI=1S/C24H44N2O4S.C2HF3O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-23(28)31-20-21(26-22(27)19-25)24(29)30-18-4-2;3-2(4,5)1(6)7/h4,21H,2-3,5-20,25H2,1H3,(H,26,27);(H,6,7)/t21-;/m0./s1
InChIKey OMPSDUGVAJRCNC-BOXHHOBZSA-N
Mol Weight 570.7 g/mol
Molecular Formula C26H45F3N2O6S
Exact Mass 570.295043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7njMt0gkNJo
Name GLYCYL-(S-PALMITOYL)-L-CYSTEINE-ALLYLESTER-HYDROTRIFLUOROACETATE;HGLYCYS(PAL)OALL*TFA
Compound Number 36
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H45F3N2O6S
InChI InChI=1S/C24H44N2O4S.C2HF3O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-23(28)31-20-21(26-22(27)19-25)24(29)30-18-4-2;3-2(4,5)1(6)7/h4,21H,2-3,5-20,25H2,1H3,(H,26,27);(H,6,7)/t21-;/m0./s1
InChIKey OMPSDUGVAJRCNC-BOXHHOBZSA-N
Literature Reference Author M.SCHELHAAS,E.NAEGELE,N.KUDER,B.BADER,J.KUHLMANN,A.WITTINGHO FER,H.WALDMANN
Literature Reference Citation CHEM.EUR.J.,5,1239(1999)
Literature Reference DOI 10.1002/(sici)1521-3765(19990401)5:4<1239::aid-chem1239>3.3.co;2-e
Molecular Weight 570.708 g/mol
Solvent CDCl3