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1-[N-(4-BIPHENYLYLMETHYL)-PIPERAZINYL-2-ETHYLAMIDO]-N-BENZYLOXY-CARBONYL-S-GLUTAMIC-ACID-5-ETHYLESTER
SpectraBase Compound ID 1gd43gA2KEj
InChI InChI=1S/C34H42N4O5/c1-2-42-32(39)18-17-31(36-34(41)43-26-28-9-5-3-6-10-28)33(40)35-19-20-37-21-23-38(24-22-37)25-27-13-15-30(16-14-27)29-11-7-4-8-12-29/h3-16,31H,2,17-26H2,1H3,(H,35,40)(H,36,41)/t31-/m1/s1
InChIKey ICMCFQDYOQYHEL-WJOKGBTCSA-N
Mol Weight 586.7 g/mol
Molecular Formula C34H42N4O5
Exact Mass 586.31552 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IWJz038olmL
Name 1-[N-(4-BIPHENYLYLMETHYL)-PIPERAZINYL-2-ETHYLAMIDO]-N-BENZYLOXY-CARBONYL-S-GLUTAMIC-ACID-5-ETHYLESTER
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H42N4O5
InChI InChI=1S/C34H42N4O5/c1-2-42-32(39)18-17-31(36-34(41)43-26-28-9-5-3-6-10-28)33(40)35-19-20-37-21-23-38(24-22-37)25-27-13-15-30(16-14-27)29-11-7-4-8-12-29/h3-16,31H,2,17-26H2,1H3,(H,35,40)(H,36,41)/t31-/m1/s1
InChIKey ICMCFQDYOQYHEL-WJOKGBTCSA-N
Literature Reference Author A.MARTINEZ,C.LANOT,C.PEREZ,A.CASTRO,P.LOPEZ-SERRANO,S.CONDE
Literature Reference Citation BIOORG.MED.CHEM.,8,731(2000)
Literature Reference DOI 10.1016/S0968-0896(00)00020-1
Molecular Weight 586.731 g/mol
Solvent CDCl3
Source File Reference UWVN20171