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ASPERJINONE;3-(3-((3,3-DIMETYHLOXIRAN-2-YL)-METHYL)-4-HYDROXYBENZYL)-4-(4-HYDROXYPHENYL)-FURAN-2,5-DIONE
SpectraBase Compound ID C0qgKnFxKiY
InChI InChI=1S/C22H20O6/c1-22(2)18(28-22)11-14-9-12(3-8-17(14)24)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 CKIQGFVEMXGQMC-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 Kv8dSSZgA0G
Name ASPERJINONE;3-(3-((3,3-DIMETYHLOXIRAN-2-YL)-METHYL)-4-HYDROXYBENZYL)-4-(4-HYDROXYPHENYL)-FURAN-2,5-DIONE
Compound Number 1
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(28-22)11-14-9-12(3-8-17(14)24)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 CKIQGFVEMXGQMC-UHFFFAOYSA-N
Literature Reference Author W.Y.LIAO,C.N.SHEN,L.H.LIN,Y.L.YANG,H.Y.HAN,J.W.CHEN,S.C.KUO, S.H.WU,C.C.LIAW
Literature Reference Citation J.NAT.PROD.,75,630(2012)
Literature Reference DOI 10.1021/np200866z
Molecular Weight 380.397 g/mol
Sample ID 40255
Solvent ACETONE-D6