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7-(N-BENZYL-PIPERAZINYL-2-ETHYLAMIDO)-N-BENZYLOXYCARBONYL-ALPHA-AMINOPIMELIC-ACID-1-ETHYLESTER
SpectraBase Compound ID IT6xiHYDKqF
InChI InChI=1S/C30H42N4O5/c1-2-38-29(36)27(32-30(37)39-24-26-13-7-4-8-14-26)15-9-10-16-28(35)31-17-18-33-19-21-34(22-20-33)23-25-11-5-3-6-12-25/h3-8,11-14,27H,2,9-10,15-24H2,1H3,(H,31,35)(H,32,37)/t27-/m0/s1
InChIKey LWTHNYXUCNIAHJ-MHZLTWQESA-N
Mol Weight 538.7 g/mol
Molecular Formula C30H42N4O5
Exact Mass 538.31552 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BuDtg7D9ESi
Name 7-(N-BENZYL-PIPERAZINYL-2-ETHYLAMIDO)-N-BENZYLOXYCARBONYL-ALPHA-AMINOPIMELIC-ACID-1-ETHYLESTER
Compound Number 1 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H42N4O5
InChI InChI=1S/C30H42N4O5/c1-2-38-29(36)27(32-30(37)39-24-26-13-7-4-8-14-26)15-9-10-16-28(35)31-17-18-33-19-21-34(22-20-33)23-25-11-5-3-6-12-25/h3-8,11-14,27H,2,9-10,15-24H2,1H3,(H,31,35)(H,32,37)/t27-/m0/s1
InChIKey LWTHNYXUCNIAHJ-MHZLTWQESA-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 538.687 g/mol
Solvent CDCl3
Source File Reference UWVN20179