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1-[6-(2,3-DIHYDROXY-3-METHYLBUTYL)-3-HYDROXY-2-HYDROXYMETHYLPHENYL]-UNDECA-1,5-DIENE-3,4-DIOL
SpectraBase Compound ID Fg7g2kbEWEg
InChI InChI=1S/C23H36O6/c1-4-5-6-7-8-9-20(26)21(27)13-11-17-16(14-22(28)23(2,3)29)10-12-19(25)18(17)15-24/h8-13,20-22,24-29H,4-7,14-15H2,1-3H3/b9-8+,13-11+
InChIKey YGAOKHUBSRHQKB-VKTMSVCMSA-N
Mol Weight 408.5 g/mol
Molecular Formula C23H36O6
Exact Mass 408.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3KxdI7uX4Qa
Name 1-[6-(2,3-DIHYDROXY-3-METHYLBUTYL)-3-HYDROXY-2-HYDROXYMETHYLPHENYL]-UNDECA-1,5-DIENE-3,4-DIOL
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H36O6
InChI InChI=1S/C23H36O6/c1-4-5-6-7-8-9-20(26)21(27)13-11-17-16(14-22(28)23(2,3)29)10-12-19(25)18(17)15-24/h8-13,20-22,24-29H,4-7,14-15H2,1-3H3/b9-8+,13-11+
InChIKey YGAOKHUBSRHQKB-VKTMSVCMSA-N
Literature Reference Author M.CHINWORRUNGSEE,P.KITTAKOOP,J.SAENBOONRUENG,P.KONGSAEREE,Y. THEBTARANONTH
Literature Reference Citation J.NAT.PROD.,69,1404(2006)
Literature Reference DOI 10.1021/np0601197
Molecular Weight 408.535 g/mol
Solvent ACETONE-D6:D2O=9:1
Source File Reference UWMZ15764