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N-[[2S,3R,(4E)]-1,3-DIHYDROXY-OCTADECA-4-EN-2-YL]-HEXADECANAMIDE
SpectraBase Compound ID LftDGG0wUvo
InChI InChI=1S/C34H67NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(37)32(31-36)35-34(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h27,29,32-33,36-37H,3-26,28,30-31H2,1-2H3,(H,35,38)/b29-27+/t32-,33+/m0/s1
InChIKey YDNKGFDKKRUKPY-TURZORIXSA-N
Mol Weight 537.9 g/mol
Molecular Formula C34H67NO3
Exact Mass 537.512095 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ldTGw5z3Tj
Name N-[[2S,3R,(4E)]-1,3-DIHYDROXY-OCTADECA-4-EN-2-YL]-HEXADECANAMIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H67NO3
InChI InChI=1S/C34H67NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(37)32(31-36)35-34(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h27,29,32-33,36-37H,3-26,28,30-31H2,1-2H3,(H,35,38)/b29-27+/t32-,33+/m0/s1
InChIKey YDNKGFDKKRUKPY-TURZORIXSA-N
Literature Reference Author J.G.L.ALMEIDA,A.I.V.MAIA,D.V.WILKE,E.R.SILVEIRA,R.BRAZ-FILHO ,J.J.L.CLAIR
Literature Reference Citation MAR.DRUGS,10,2846(2012)
Literature Reference DOI 10.3390/md10122846
Molecular Weight 537.911 g/mol
Source File Reference UWIR6093