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5,4'-DIHYDROXY-6-(3''-METHYLBUT-2''-ENYL)-2'''-(4'''-HYDROXY-4'''-METHYLETHYL)-3'''-METHOXYDIHYDROFURANO-[4''',5''';7,8]-ISOFLAVONE
SpectraBase Compound ID 1wj5Aok7T0O
InChI InChI=1S/C26H28O7/c1-13(2)6-11-16-20(28)18-21(29)17(14-7-9-15(27)10-8-14)12-32-23(18)19-22(16)33-25(24(19)31-5)26(3,4)30/h6-10,12,24-25,27-28,30H,11H2,1-5H3/t24-,25-/m1/s1
InChIKey DTTYOIOSVDOSOG-JWQCQUIFSA-N
Mol Weight 452.5 g/mol
Molecular Formula C26H28O7
Exact Mass 452.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HyieD0tfMPP
Name 5,4'-DIHYDROXY-6-(3''-METHYLBUT-2''-ENYL)-2'''-(4'''-HYDROXY-4'''-METHYLETHYL)-3'''-METHOXYDIHYDROFURANO-[4''',5''';7,8]-ISOFLAVONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H28O7
InChI InChI=1S/C26H28O7/c1-13(2)6-11-16-20(28)18-21(29)17(14-7-9-15(27)10-8-14)12-32-23(18)19-22(16)33-25(24(19)31-5)26(3,4)30/h6-10,12,24-25,27-28,30H,11H2,1-5H3/t24-,25-/m1/s1
InChIKey DTTYOIOSVDOSOG-JWQCQUIFSA-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 452.504 g/mol
Sample ID 32080
Solvent ACETONE-D6