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MALAFERIN-C;(-)-EPICATECHIN-3-O-(E)-FERULATE
SpectraBase Compound ID 6JCQ9pUWo9I
InChI InChI=1S/C25H22O9/c1-32-22-8-13(2-5-18(22)28)3-7-24(31)33-23-12-16-19(29)10-15(26)11-21(16)34-25(23)14-4-6-17(27)20(30)9-14/h2-11,23,25-30H,12H2,1H3/b7-3+/t23-,25-/m1/s1
InChIKey LVTOMVMZKATNOW-LJXLSVORSA-N
Mol Weight 466.44 g/mol
Molecular Formula C25H22O9
Exact Mass 466.126382 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BU5rWSXhEyw
Name MALAFERIN-C;(-)-EPICATECHIN-3-O-(E)-FERULATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H22O9
InChI InChI=1S/C25H22O9/c1-32-22-8-13(2-5-18(22)28)3-7-24(31)33-23-12-16-19(29)10-15(26)11-21(16)34-25(23)14-4-6-17(27)20(30)9-14/h2-11,23,25-30H,12H2,1H3/b7-3+/t23-,25-/m1/s1
InChIKey LVTOMVMZKATNOW-LJXLSVORSA-N
Literature Reference Author X.D.WU,J.T.CHENG,J.HE,X.J.ZHANG,L.B.DONG,X.GONG,L.D.SONG,Y.T .ZHENG,L.Y.PENG,Q.S.
Literature Reference Citation FITOTERAPIA,83,1068(2012)
Literature Reference DOI 10.1016/j.fitote.2012.05.006
Molecular Weight 466.444 g/mol
Sample ID 71983
Solvent CD3OD