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2-[(2'E,6'Z,10'E,14'Z)-5'-Oxo-15'-hydroxymethyl-3',7',11'-trimethylhexadeca-2',6',10',14'-tetraenyl]-6-methylhydroquinone

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2-[(2'E,6'Z,10'E,14'Z)-5'-Oxo-15'-hydroxymethyl-3',7',11'-trimethylhexadeca-2',6',10',14'-tetraenyl]-6-methylhydroquinone
SpectraBase Compound ID 7CBsVWVYaj
InChI InChI=1S/C27H38O4/c1-19(9-7-11-22(4)18-28)8-6-10-20(2)14-25(29)15-21(3)12-13-24-17-26(30)16-23(5)27(24)31/h8,11-12,14,16-17,28,30-31H,6-7,9-10,13,15,18H2,1-5H3/b19-8+,20-14-,21-12+,22-11+
InChIKey AUMNDJSQPDHCKI-XOHMPSQFSA-N
Mol Weight 426.6 g/mol
Molecular Formula C27H38O4
Exact Mass 426.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LICsKQCgXYx
Name 2-[(2'E,6'Z,10'E,14'Z)-5'-OXO-15'-HYDROXYMETHYL-3',7',11'-TRIMETHYLHEXADECA-2',6',10',14'-TETRAENYL]-6-METHYLHYDROQUINONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H38O4
InChI InChI=1S/C27H38O4/c1-19(9-7-11-22(4)18-28)8-6-10-20(2)14-25(29)15-21(3)12-13-24-17-26(30)16-23(5)27(24)31/h8,11-12,14,16-17,28,30-31H,6-7,9-10,13,15,18H2,1-5H3/b19-8+,20-14-,21-12+,22-11+
InChIKey AUMNDJSQPDHCKI-XOHMPSQFSA-N
Literature Reference Author K.M.FISCH,V.BOEHM,A.D.WRIGHT,G.M.KOENIG
Literature Reference Citation J.NAT.PROD.,66,968(2003)
Literature Reference DOI 10.1021/np030082f
Molecular Weight 426.596 g/mol
Solvent ACETONE-D6
Source File Reference UWSP96