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ASPERJINONE;3-[(3-HYDROXY-2,2-DIMETHYL-3,4-DIHYDRO-2-H-CHROMEN-6-YL)-METHYL]-4-(4-HYDROXYPHENYL)-FURAN-2,5-DIONE
SpectraBase Compound ID IadmErSwrfL
InChI InChI=1S/C22H20O6/c1-22(2)18(24)11-14-9-12(3-8-17(14)28-22)10-16-19(21(26)27-20(16)25)13-4-6-15(23)7-5-13/h3-9,18,23-24H,10-11H2,1-2H3
InChIKey NESQQMMROWJYSV-UHFFFAOYSA-N
Mol Weight 380.4 g/mol
Molecular Formula C22H20O6
Exact Mass 380.125988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2WMFZE3rTJ2
Name ASPERJINONE;3-[(3-HYDROXY-2,2-DIMETHYL-3,4-DIHYDRO-2-H-CHROMEN-6-YL)-METHYL]-4-(4-HYDROXYPHENYL)-FURAN-2,5-DIONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20O6
InChI InChI=1S/C22H20O6/c1-22(2)18(24)11-14-9-12(3-8-17(14)28-22)10-16-19(21(26)27-20(16)25)13-4-6-15(23)7-5-13/h3-9,18,23-24H,10-11H2,1-2H3
InChIKey NESQQMMROWJYSV-UHFFFAOYSA-N
Literature Reference Author M.ELYASHBERG,K.BLINOV,S.MOLODTSOV,A.J.WILLIAMS
Literature Reference Citation J.NAT.PROD.,76,113(2013)
Literature Reference DOI 10.1021/np300218g
Molecular Weight 380.397 g/mol
Sample ID 42010
Solvent ACETONE-D6