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(S,E)-4-ETHOXY-4-OXOBUT-2-ENYL_5-AMINO-2-(TERT.-BUTOXYCARBONYLAMINO)-5-OXOPENTANOATE
SpectraBase Compound ID 56UVYy6hns0
InChI InChI=1S/C16H26N2O7/c1-5-23-13(20)7-6-10-24-14(21)11(8-9-12(17)19)18-15(22)25-16(2,3)4/h6-7,11H,5,8-10H2,1-4H3,(H2,17,19)(H,18,22)/b7-6+/t11-/m0/s1
InChIKey NQIKMWIAFZCGKA-MLRMMBSGSA-N
Mol Weight 358.39 g/mol
Molecular Formula C16H26N2O7
Exact Mass 358.174001 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FF8bpaI2tRY
Name (S,E)-4-ETHOXY-4-OXOBUT-2-ENYL_5-AMINO-2-(TERT.-BUTOXYCARBONYLAMINO)-5-OXOPENTANOATE
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H26N2O7
InChI InChI=1S/C16H26N2O7/c1-5-23-13(20)7-6-10-24-14(21)11(8-9-12(17)19)18-15(22)25-16(2,3)4/h6-7,11H,5,8-10H2,1-4H3,(H2,17,19)(H,18,22)/b7-6+/t11-/m0/s1
InChIKey NQIKMWIAFZCGKA-MLRMMBSGSA-N
Literature Reference Author A.BREUNING,B.DEGEL,F.SCHULZ,C.BUECHOLD,M.STEMPKA,U.MACHON,S. HEPPNER,C.GELHAUS,M.
Literature Reference Citation J.MED.CHEM.,53,1951(2010)
Literature Reference DOI 10.1021/jm900946n
Molecular Weight 358.392 g/mol
Solvent CDCl3
Source File Reference UWMZ46504