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((2'R,3'S,4'S)-3'-ACETAMIDO-4'-(BENZYLOXY)-2'-[(1''S,2''R)-1'',2'',3''-TRIS-(BENZYLOXY)-PROPYL]-PYRROLIDIN-1'-YL)-ACETIC-ACID

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((2'R,3'S,4'S)-3'-ACETAMIDO-4'-(BENZYLOXY)-2'-[(1''S,2''R)-1'',2'',3''-TRIS-(BENZYLOXY)-PROPYL]-PYRROLIDIN-1'-YL)-ACETIC-ACID
SpectraBase Compound ID 6yESoH39i4E
InChI InChI=1S/C39H44N2O7/c1-29(42)40-37-34(46-25-31-16-8-3-9-17-31)22-41(23-36(43)44)38(37)39(48-27-33-20-12-5-13-21-33)35(47-26-32-18-10-4-11-19-32)28-45-24-30-14-6-2-7-15-30/h2-21,34-35,37-39H,22-28H2,1H3,(H,40,42)(H,43,44)/t34-,35?,37+,38+,39?/m1/s1
InChIKey OWDZAQWQGSOZTK-JOWKXFDMSA-N
Mol Weight 652.8 g/mol
Molecular Formula C39H44N2O7
Exact Mass 652.314852 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EtNt64d7D6X
Name ((2'R,3'S,4'S)-3'-ACETAMIDO-4'-(BENZYLOXY)-2'-[(1''S,2''R)-1'',2'',3''-TRIS-(BENZYLOXY)-PROPYL]-PYRROLIDIN-1'-YL)-ACETIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H44N2O7
InChI InChI=1S/C39H44N2O7/c1-29(42)40-37-34(46-25-31-16-8-3-9-17-31)22-41(23-36(43)44)38(37)39(48-27-33-20-12-5-13-21-33)35(47-26-32-18-10-4-11-19-32)28-45-24-30-14-6-2-7-15-30/h2-21,34-35,37-39H,22-28H2,1H3,(H,40,42)(H,43,44)/t34-,35?,37+,38+,39?/m1/s1
InChIKey OWDZAQWQGSOZTK-JOWKXFDMSA-N
Literature Reference Author L.CZOLLNER,J.KUSZMANN,A.VASELLA
Literature Reference Citation HELV.CHIM.ACTA,73,1338(1990)
Literature Reference DOI 10.1002/hlca.19900730522
Molecular Weight 652.788 g/mol
Solvent CDCl3
Source File Reference UWCS2631