John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=ne63O0kfxW SpectraBase Spectrum ID=29u1Glg1IAc

(accessed ).
N-[(TERT.-BUTYLOXY)-CARBONYL]-0-(5)-BENZYL-L-GLUTAM-1-YL-L-GLUTAMINYL-L-PHENYLALANINOL
SpectraBase Compound ID ne63O0kfxW
InChI InChI=1S/C31H42N4O8/c1-31(2,3)43-30(41)35-25(15-17-27(38)42-20-22-12-8-5-9-13-22)29(40)34-24(14-16-26(32)37)28(39)33-23(19-36)18-21-10-6-4-7-11-21/h4-13,23-25,36H,14-20H2,1-3H3,(H2,32,37)(H,33,39)(H,34,40)(H,35,41)/t23?,24-,25-/m1/s1
InChIKey GPWSNPKMYYLKTK-OPWSDZRHSA-N
Mol Weight 598.7 g/mol
Molecular Formula C31H42N4O8
Exact Mass 598.300265 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 29u1Glg1IAc
Name N-[(TERT.-BUTYLOXY)-CARBONYL]-0-(5)-BENZYL-L-GLUTAM-1-YL-L-GLUTAMINYL-L-PHENYLALANINOL
Compound Number 9A
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H42N4O8
InChI InChI=1S/C31H42N4O8/c1-31(2,3)43-30(41)35-25(15-17-27(38)42-20-22-12-8-5-9-13-22)29(40)34-24(14-16-26(32)37)28(39)33-23(19-36)18-21-10-6-4-7-11-21/h4-13,23-25,36H,14-20H2,1-3H3,(H2,32,37)(H,33,39)(H,34,40)(H,35,41)/t23?,24-,25-/m1/s1
InChIKey GPWSNPKMYYLKTK-OPWSDZRHSA-N
Literature Reference Author P.WIPF,H.HEIMGARTNER
Literature Reference Citation HELV.CHIM.ACTA,73,13(1990)
Literature Reference DOI 10.1002/hlca.19900730103
Molecular Weight 598.696 g/mol
Solvent CDCl3
Source File Reference UWCS12390
SpectraBase Batch ID Lt0ho4gRVFa