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4,5-BETA-DIHYDROXY-5-(8',9'-HEPTADECENYL)-2-CYClOHEXENONE
SpectraBase Compound ID Hwn5PLBc6rj
InChI InChI=1S/C23H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-23(26)20-21(24)17-18-22(23)25/h9-10,17-18,22,25-26H,2-8,11-16,19-20H2,1H3/b10-9-/t22-,23-/m0/s1
InChIKey ZPYABTHUTGWONW-RXWKEIDKSA-N
Mol Weight 364.6 g/mol
Molecular Formula C23H40O3
Exact Mass 364.297745 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3mlZRTAeEmr
Name 4,5-BETA-DIHYDROXY-5-(8',9'-HEPTADECENYL)-2-CYClOHEXENONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H40O3
InChI InChI=1S/C23H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-23(26)20-21(24)17-18-22(23)25/h9-10,17-18,22,25-26H,2-8,11-16,19-20H2,1H3/b10-9-/t22-,23-/m0/s1
InChIKey ZPYABTHUTGWONW-RXWKEIDKSA-N
Literature Reference Author A.GROWEISS,J.H.CARDELLINA,L.K.PANNELL,D.UYAKUL,Y.KASHMAN,M.R .BOYD
Literature Reference Citation J.NAT.PROD.,60,116(1997)
Literature Reference DOI 10.1021/np960435t
Molecular Weight 364.569 g/mol
Solvent CDCl3
Source File Reference UWGS117