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N-ALLYLOXYCARBONYL-L-LEUCYL-L-PROLYL-(S-FARNESYL)-L-CYSTEINE-METHYLESTER;ALOCLEUPROCYS(FAR)OME
SpectraBase Compound ID FypvvU5M1pD
InChI InChI=1S/C34H55N3O6S/c1-9-20-43-34(41)36-28(22-25(4)5)32(39)37-19-12-17-30(37)31(38)35-29(33(40)42-8)23-44-21-18-27(7)16-11-15-26(6)14-10-13-24(2)3/h9,13,15,18,25,28-30H,1,10-12,14,16-17,19-23H2,2-8H3,(H,35,38)(H,36,41)/b26-15+,27-18+/t28-,29-,30+/m1/s1
InChIKey MZWDSXLWACMPKG-WXNMXVSVSA-N
Mol Weight 633.9 g/mol
Molecular Formula C34H55N3O6S
Exact Mass 633.381158 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JFchV4n19kz
Name N-ALLYLOXYCARBONYL-L-LEUCYL-L-PROLYL-(S-FARNESYL)-L-CYSTEINE-METHYLESTER;ALOCLEUPROCYS(FAR)OME
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H55N3O6S
InChI InChI=1S/C34H55N3O6S/c1-9-20-43-34(41)36-28(22-25(4)5)32(39)37-19-12-17-30(37)31(38)35-29(33(40)42-8)23-44-21-18-27(7)16-11-15-26(6)14-10-13-24(2)3/h9,13,15,18,25,28-30H,1,10-12,14,16-17,19-23H2,2-8H3,(H,35,38)(H,36,41)/b26-15+,27-18+/t28-,29-,30+/m1/s1
InChIKey MZWDSXLWACMPKG-WXNMXVSVSA-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 633.887 g/mol
Solvent CDCl3
Source File Reference UWRU9614