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OKUNDOPEROXIDE;(+)-(3-R*,4A-S*,8A-S*)-3-[(E)-4-HYDROXYBUT-2-EN-2-YL]-5,5,8A-TRIMETHYL-3,4,4A,5-TETRAHYDROBENZO-[C]-[1.2]-DIOXIN-6-(8A-H)-ONE

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OKUNDOPEROXIDE;(+)-(3-R*,4A-S*,8A-S*)-3-[(E)-4-HYDROXYBUT-2-EN-2-YL]-5,5,8A-TRIMETHYL-3,4,4A,5-TETRAHYDROBENZO-[C]-[1.2]-DIOXIN-6-(8A-H)-ONE
SpectraBase Compound ID 420JCiH2sYL
InChI InChI=1S/C15H22O4/c1-10(6-8-16)11-9-12-14(2,3)13(17)5-7-15(12,4)19-18-11/h5-7,11-12,16H,8-9H2,1-4H3/b10-6+/t11-,12+,15+/m1/s1
InChIKey NUNJRUBEEMMTJA-JBTZHDNBSA-N
Mol Weight 266.34 g/mol
Molecular Formula C15H22O4
Exact Mass 266.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 18DZbcSeAm5
Name OKUNDOPEROXIDE;(+)-(3-R*,4A-S*,8A-S*)-3-[(E)-4-HYDROXYBUT-2-EN-2-YL]-5,5,8A-TRIMETHYL-3,4,4A,5-TETRAHYDROBENZO-[C]-[1.2]-DIOXIN-6-(8A-H)-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H22O4
InChI InChI=1S/C15H22O4/c1-10(6-8-16)11-9-12-14(2,3)13(17)5-7-15(12,4)19-18-11/h5-7,11-12,16H,8-9H2,1-4H3/b10-6+/t11-,12+,15+/m1/s1
InChIKey NUNJRUBEEMMTJA-JBTZHDNBSA-N
Literature Reference Author S.M.N.EFANGE,R.BRUN,S.WITTLIN,J.D.CONNOLLY,T.R.HOYE,T.MCAKAM ,F.L.MAKOLO,J.A.MBAH
Literature Reference Citation J.NAT.PROD.,72,280(2009)
Literature Reference DOI 10.1021/np800338p
Molecular Weight 266.337 g/mol
Sample ID 32204
Solvent CDCl3