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5,7,4'-TRIHYDROXY-3'-[7-HYDROXY-3,7-DIMETHYL-(2E)-OCTENYL]-ISOFLAVONE
SpectraBase Compound ID 2i2AwSNjY4c
InChI InChI=1S/C25H28O6/c1-15(5-4-10-25(2,3)30)6-7-17-11-16(8-9-20(17)27)19-14-31-22-13-18(26)12-21(28)23(22)24(19)29/h6,8-9,11-14,26-28,30H,4-5,7,10H2,1-3H3/b15-6+
InChIKey PDLBZGJKGCEGQH-GIDUJCDVSA-N
Mol Weight 424.49 g/mol
Molecular Formula C25H28O6
Exact Mass 424.188589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JFstKdwVVTT
Name 5,7,4'-TRIHYDROXY-3'-[7-HYDROXY-3,7-DIMETHYL-(2E)-OCTENYL]-ISOFLAVONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O6
InChI InChI=1S/C25H28O6/c1-15(5-4-10-25(2,3)30)6-7-17-11-16(8-9-20(17)27)19-14-31-22-13-18(26)12-21(28)23(22)24(19)29/h6,8-9,11-14,26-28,30H,4-5,7,10H2,1-3H3/b15-6+
InChIKey PDLBZGJKGCEGQH-GIDUJCDVSA-N
Literature Reference Author Q.Y.SHOU,R.Z.FU,Q.TAN,Z.W.SHEN
Literature Reference Citation J.AGR.FOOD.CHEM.,57,6712(2009)
Literature Reference DOI 10.1021/jf9009894
Molecular Weight 424.494 g/mol
Sample ID 68073
Solvent ACETONE-D6