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(Z,Z,E)-1-ACETOXY-2-HYDROXY-4-OXO-HENEICOSA-5,12,15-TRIENE
SpectraBase Compound ID 3QcPRtXuFtg
InChI InChI=1S/C23H38O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(25)19-23(26)20-27-21(2)24/h7-8,10-11,17-18,23,26H,3-6,9,12-16,19-20H2,1-2H3/b8-7-,11-10-,18-17+/t23-/m1/s1
InChIKey YLWJMUPPJKELEC-RSWURYEXSA-N
Mol Weight 378.6 g/mol
Molecular Formula C23H38O4
Exact Mass 378.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2l5SO1A7E8B
Name (Z,Z,E)-1-ACETOXY-2-HYDROXY-4-OXO-HENEICOSA-5,12,15-TRIENE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H38O4
InChI InChI=1S/C23H38O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(25)19-23(26)20-27-21(2)24/h7-8,10-11,17-18,23,26H,3-6,9,12-16,19-20H2,1-2H3/b8-7-,11-10-,18-17+/t23-/m1/s1
InChIKey YLWJMUPPJKELEC-RSWURYEXSA-N
Literature Reference Author F.DOMERGUE,G.L.HELMS,D.PRUSKY,J.BROWSE
Literature Reference Citation PHYTOCHEM.,54,183(2000)
Literature Reference DOI 10.1016/S0031-9422(00)00055-8
Molecular Weight 378.552 g/mol
Solvent CDCl3
Source File Reference UWLU1236