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GENISTEIN-7-ACETYLFERULIC-ACID
SpectraBase Compound ID 45fDcjABFkQ
InChI InChI=1S/C27H20O9/c1-15(28)35-22-9-3-16(11-23(22)33-2)4-10-25(31)36-19-12-21(30)26-24(13-19)34-14-20(27(26)32)17-5-7-18(29)8-6-17/h3-14,29-30H,1-2H3/b10-4+
InChIKey CRCVUZGACVPCMP-ONNFQVAWSA-N
Mol Weight 488.45 g/mol
Molecular Formula C27H20O9
Exact Mass 488.110732 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7L4mEYVWc77
Name GENISTEIN-7-ACETYLFERULIC-ACID
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H20O9
InChI InChI=1S/C27H20O9/c1-15(28)35-22-9-3-16(11-23(22)33-2)4-10-25(31)36-19-12-21(30)26-24(13-19)34-14-20(27(26)32)17-5-7-18(29)8-6-17/h3-14,29-30H,1-2H3/b10-4+
InChIKey CRCVUZGACVPCMP-ONNFQVAWSA-N
Literature Reference Author P.LI,X.SHI,Y.WEI,L.QIN,W.SUN,G.XU,T.XU,T.LIU
Literature Reference Citation MOLECULES,20,17016(2015)
Literature Reference DOI 10.3390/molecules200917016
Molecular Weight 488.450 g/mol
Solvent DMSO-D6
Source File Reference UWPA5156