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#8A+8B;(6R,7S,11R,2'S/2'R)-11-HYDROXY-13-[4'-METHYL-3'-ENE-2'-OXY-GAMMA-BUTYROLACTONE]-4(15),10(14)-DIENE-GUAIANE-6-ALPHA,12-OLIDE;MIXTURE;MAJOR+MINOR
SpectraBase Compound ID DeGgeEa1t9l
InChI InChI=1S/2C20H24O6/c2*1-10-5-7-14-17(16-11(2)4-6-13(10)16)26-19(22)20(14,23)9-24-15-8-12(3)18(21)25-15/h2*8,13-17,23H,1-2,4-7,9H2,3H3/t13-,14+,15+,16-,17-,20-;13-,14+,15-,16-,17-,20-/m00/s1
InChIKey DEVMKGDQXAFFMG-WCCQIJLOSA-N
Mol Weight 720.81 g/mol
Molecular Formula C40H48O12
Exact Mass 720.314577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5LinN9Ho4P5
Name #8A+8B;(6R,7S,11R,2'S/2'R)-11-HYDROXY-13-[4'-METHYL-3'-ENE-2'-OXY-GAMMA-BUTYROLACTONE]-4(15),10(14)-DIENE-GUAIANE-6-ALPHA,12-OLIDE;MIXTURE;MAJOR+MINOR
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H48O12
InChI InChI=1S/2C20H24O6/c2*1-10-5-7-14-17(16-11(2)4-6-13(10)16)26-19(22)20(14,23)9-24-15-8-12(3)18(21)25-15/h2*8,13-17,23H,1-2,4-7,9H2,3H3/t13-,14+,15+,16-,17-,20-;13-,14+,15-,16-,17-,20-/m00/s1
InChIKey DEVMKGDQXAFFMG-WCCQIJLOSA-N
Literature Reference Author F.A.MACIAS,M.D.GARCIA-DIAZ,A.PEREZ-DE-LUQUE,D.RUBIALES,J.C.G .GALINDO
Literature Reference Citation J.AGR.FOOD.CHEM.,57,5853(2009)
Literature Reference DOI 10.1021/jf900870j
Molecular Weight 720.814 g/mol
Sample ID 68018
Solvent CDCl3