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(E)-4-[5,7-DIHYDROXY-2-(4-HYDROXYPHENYL)-4-OXO-3,4-DIHYDRO-2H-CHROMEN-8-YL]-2-METHYL-2-BUTENAL
SpectraBase Compound ID A2FBqGVTfKd
InChI InChI=1S/C20H18O6/c1-11(10-21)2-7-14-15(23)8-16(24)19-17(25)9-18(26-20(14)19)12-3-5-13(22)6-4-12/h2-6,8,10,18,22-24H,7,9H2,1H3/b11-2+/t18-/m0/s1
InChIKey YYBFHGGYEOYVED-MKVPMMLLSA-N
Mol Weight 354.36 g/mol
Molecular Formula C20H18O6
Exact Mass 354.110338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DapnuC6OGBO
Name (E)-4-[5,7-DIHYDROXY-2-(4-HYDROXYPHENYL)-4-OXO-3,4-DIHYDRO-2H-CHROMEN-8-YL]-2-METHYL-2-BUTENAL
Compound Number M 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18O6
InChI InChI=1S/C20H18O6/c1-11(10-21)2-7-14-15(23)8-16(24)19-17(25)9-18(26-20(14)19)12-3-5-13(22)6-4-12/h2-6,8,10,18,22-24H,7,9H2,1H3/b11-2+/t18-/m0/s1
InChIKey YYBFHGGYEOYVED-MKVPMMLLSA-N
Literature Reference Author D.NIKOLIC,Y.LI,L.R.CHADWICK,S.GRUBJESIC,P.SCWAB,P.METZ,R.B.V .BREEMEN
Literature Reference Citation DRUG.MET.DISP.,32,272(2004)
Literature Reference DOI 10.1124/dmd.32.2.272
Molecular Weight 354.359 g/mol
Source File Reference UWLU74284