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ALLYL-(E,3R,4R,5S)-N-BENZYLOXYCARBONYL-N-TERT.-BUTOXYCARBONYL-ALPHA-(5-BENZYLOXYMETHYL-3,4-DIBENZYLOXYPYRROLIDINE-2-YLIDENE)-GLYCINATE

View entire compound with spectra: 1 NMR

ALLYL-(E,3R,4R,5S)-N-BENZYLOXYCARBONYL-N-TERT.-BUTOXYCARBONYL-ALPHA-(5-BENZYLOXYMETHYL-3,4-DIBENZYLOXYPYRROLIDINE-2-YLIDENE)-GLYCINATE
SpectraBase Compound ID 3cXFhoTNvGs
InChI InChI=1S/C39H40N2O7/c1-2-23-45-38(42)35(41-39(43)48-27-32-21-13-6-14-22-32)34-37(47-26-31-19-11-5-12-20-31)36(46-25-30-17-9-4-10-18-30)33(40-34)28-44-24-29-15-7-3-8-16-29/h2-22,33,36-37,40H,1,23-28H2,(H,41,43)/b35-34+/t33-,36+,37+/m0/s1
InChIKey SSMNYGTZRDQSKE-YSQNNNCDSA-N
Mol Weight 648.8 g/mol
Molecular Formula C39H40N2O7
Exact Mass 648.283552 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID TnluHC6Nup
Name ALLYL-(E,3R,4R,5S)-N-BENZYLOXYCARBONYL-N-TERT.-BUTOXYCARBONYL-ALPHA-(5-BENZYLOXYMETHYL-3,4-DIBENZYLOXYPYRROLIDINE-2-YLIDENE)-GLYCINATE
Compound Number 5D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H40N2O7
InChI InChI=1S/C39H40N2O7/c1-2-23-45-38(42)35(41-39(43)48-27-32-21-13-6-14-22-32)34-37(47-26-31-19-11-5-12-20-31)36(46-25-30-17-9-4-10-18-30)33(40-34)28-44-24-29-15-7-3-8-16-29/h2-22,33,36-37,40H,1,23-28H2,(H,41,43)/b35-34+/t33-,36+,37+/m0/s1
InChIKey SSMNYGTZRDQSKE-YSQNNNCDSA-N
Literature Reference Author Y.KONDA-YAMADA,K.ASANO,T.SATOU,S.MONMA,M.SAKAYANAGI,N.SATOU, K.TAKEDA,Y.HARIGAYA
Literature Reference Citation CHEM.PHARM.BULL.,53,529(2005)
Literature Reference DOI 10.1248/cpb.53.529
Molecular Weight 648.756 g/mol
Sample ID 54081
Solvent CDCl3