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3-BETA,8-ALPHA-O-DI-(4-HYDROXYTIGLOYL)-1-ALPHA-H,5-ALPHA-H,6-BETA-H,7-ALPHA-H-GUAI-4(15),10(14),11(13)-TRIENE-6,12-OLIDE
SpectraBase Compound ID CeFVUZKKQYc
InChI InChI=1S/C25H30O8/c1-12(6-8-26)23(28)31-18-11-17-14(3)10-19(32-24(29)13(2)7-9-27)21-16(5)25(30)33-22(21)20(17)15(18)4/h6-7,17-22,26-27H,3-5,8-11H2,1-2H3/b12-6+,13-7+/t17-,18+,19+,20+,21-,22-/m1/s1
InChIKey GEQSUPKOPQFUSB-SVIQKONGSA-N
Mol Weight 458.51 g/mol
Molecular Formula C25H30O8
Exact Mass 458.194068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FSIqa2LHRmU
Name 3-BETA,8-ALPHA-O-DI-(4-HYDROXYTIGLOYL)-1-ALPHA-H,5-ALPHA-H,6-BETA-H,7-ALPHA-H-GUAI-4(15),10(14),11(13)-TRIENE-6,12-OLIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H30O8
InChI InChI=1S/C25H30O8/c1-12(6-8-26)23(28)31-18-11-17-14(3)10-19(32-24(29)13(2)7-9-27)21-16(5)25(30)33-22(21)20(17)15(18)4/h6-7,17-22,26-27H,3-5,8-11H2,1-2H3/b12-6+,13-7+/t17-,18+,19+,20+,21-,22-/m1/s1
InChIKey GEQSUPKOPQFUSB-SVIQKONGSA-N
Literature Reference Author A.M.HELAL,N.NAKAMURA,M.R.MESELHY,A.M.EL-FISHAWY,M.HATTORI,G. H.MAHRAN
Literature Reference Citation PHYTOCHEM.,45,551(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00844-8
Molecular Weight 458.508 g/mol
Solvent CDCl3
Source File Reference UWSP1438