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5,4'-DIHYDROXY-8-(3''-METHYLBUT-2''-ENYL)-2'''-(4'''-HYDROXY-4'''-METHYLETHYL)-FURANO-[4''',5''';6,7]-ISOFLAVONE
SpectraBase Compound ID 6zObiVtXxKh
InChI InChI=1S/C25H24O6/c1-13(2)5-10-16-23-17(11-19(31-23)25(3,4)29)21(27)20-22(28)18(12-30-24(16)20)14-6-8-15(26)9-7-14/h5-9,11-12,26-27,29H,10H2,1-4H3
InChIKey ZJPXKVGTXCAVOR-UHFFFAOYSA-N
Mol Weight 420.46 g/mol
Molecular Formula C25H24O6
Exact Mass 420.157288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JVVxK7rs7lM
Name 5,4'-DIHYDROXY-8-(3''-METHYLBUT-2''-ENYL)-2'''-(4'''-HYDROXY-4'''-METHYLETHYL)-FURANO-[4''',5''';6,7]-ISOFLAVONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H24O6
InChI InChI=1S/C25H24O6/c1-13(2)5-10-16-23-17(11-19(31-23)25(3,4)29)21(27)20-22(28)18(12-30-24(16)20)14-6-8-15(26)9-7-14/h5-9,11-12,26-27,29H,10H2,1-4H3
InChIKey ZJPXKVGTXCAVOR-UHFFFAOYSA-N
Literature Reference Author X.H.HAN,S.S.HONG,Q.JIN,D.LI,H.K.KIM,J.LEE,S.H.KWON,D.LEE,C.K .LEE,M.K.LEE,B.Y.HWA
Literature Reference Citation J.NAT.PROD.,72,164(2009)
Literature Reference DOI 10.1021/np800418j
Molecular Weight 420.462 g/mol
Sample ID 32081
Solvent CDCl3