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#22;(+)-(5R,4'S)-6-[N,3'-BIS-(TERT.-BUTOXYCARBONYL)-1'-(PARA-METHOXYPHENYLCARBAMOYL)-2'-IMINOIMIDAZOLIDIN-4'-YL]-5-(PARA-METHOXYBENZYLOXY)-HEXANOIC-ACID

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#22;(+)-(5R,4'S)-6-[N,3'-BIS-(TERT.-BUTOXYCARBONYL)-1'-(PARA-METHOXYPHENYLCARBAMOYL)-2'-IMINOIMIDAZOLIDIN-4'-YL]-5-(PARA-METHOXYBENZYLOXY)-HEXANOIC-ACID
SpectraBase Compound ID 5CkIKb4ePxL
InChI InChI=1S/C35H48N4O10/c1-34(2,3)48-32(43)37-30-38(31(42)36-24-14-18-27(46-8)19-15-24)21-25(39(30)33(44)49-35(4,5)6)20-28(10-9-11-29(40)41)47-22-23-12-16-26(45-7)17-13-23/h12-19,25,28H,9-11,20-22H2,1-8H3,(H,36,42)(H,40,41)/b37-30-/t25-,28+/m0/s1
InChIKey XUXOXQVLUIWREG-JYQHXZTRSA-N
Mol Weight 684.8 g/mol
Molecular Formula C35H48N4O10
Exact Mass 684.337044 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J02EyWkU2gf
Name #22;(+)-(5R,4'S)-6-[N,3'-BIS-(TERT.-BUTOXYCARBONYL)-1'-(PARA-METHOXYPHENYLCARBAMOYL)-2'-IMINOIMIDAZOLIDIN-4'-YL]-5-(PARA-METHOXYBENZYLOXY)-HEXANOIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H48N4O10
InChI InChI=1S/C35H48N4O10/c1-34(2,3)48-32(43)37-30-38(31(42)36-24-14-18-27(46-8)19-15-24)21-25(39(30)33(44)49-35(4,5)6)20-28(10-9-11-29(40)41)47-22-23-12-16-26(45-7)17-13-23/h12-19,25,28H,9-11,20-22H2,1-8H3,(H,36,42)(H,40,41)/b37-30-/t25-,28+/m0/s1
InChIKey XUXOXQVLUIWREG-JYQHXZTRSA-N
Literature Reference Author S.TSUCHIYA,T.SUNAZUKA,T.HIROSE,R.MORI,T.TANAKA,M.IWATSUKI,S. OMURA
Literature Reference Citation ORG.LETTERS,8,5577(2006)
Literature Reference DOI 10.1021/ol062282z
Molecular Weight 684.787 g/mol
Sample ID 58215
Solvent CDCl3