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4'-O-METHYL-ZYGOLONE-A;8-HYDROXY-3-(3'-HYDROXY-4'-METHOXYPHENYL)-6,7-(2'',2''-DIMETHYLCHROMENE)-TETRALONE
SpectraBase Compound ID E0vpcsNPihK
InChI InChI=1S/C22H22O5/c1-22(2)7-6-15-19(27-22)11-14-8-13(10-17(24)20(14)21(15)25)12-4-5-18(26-3)16(23)9-12/h4-7,9,11,13,23,25H,8,10H2,1-3H3/t13-/m1/s1
InChIKey GXTIFVOSKSLTKY-CYBMUJFWSA-N
Mol Weight 366.41 g/mol
Molecular Formula C22H22O5
Exact Mass 366.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KrnBIMsJMk
Name 4'-O-METHYL-ZYGOLONE-A;8-HYDROXY-3-(3'-HYDROXY-4'-METHOXYPHENYL)-6,7-(2'',2''-DIMETHYLCHROMENE)-TETRALONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O5
InChI InChI=1S/C22H22O5/c1-22(2)7-6-15-19(27-22)11-14-8-13(10-17(24)20(14)21(15)25)12-4-5-18(26-3)16(23)9-12/h4-7,9,11,13,23,25H,8,10H2,1-3H3/t13-/m1/s1
InChIKey GXTIFVOSKSLTKY-CYBMUJFWSA-N
Literature Reference Author N.ALLOUCHE,B.MORLEO,O.THOISON,V.DUMONTET,O.NOSJEAN,F.GUERITT E,T.SEVENET,M.LITAUD
Literature Reference Citation PHYTOCHEM.,69,1750(2008)
Literature Reference DOI 10.1016/j.phytochem.2008.01.025
Molecular Weight 366.414 g/mol
Sample ID 44135
Solvent CDCl3