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4'-O-(6''-O-GALLOYL-BETA-D-GLUCOPYRANOSYL)-2'-HYDROXY-4-METHOXYCHALCONE
SpectraBase Compound ID J9hT2FsfQYl
InChI InChI=1S/C29H28O13/c1-39-16-5-2-14(3-6-16)4-9-19(30)18-8-7-17(12-20(18)31)41-29-27(37)26(36)25(35)23(42-29)13-40-28(38)15-10-21(32)24(34)22(33)11-15/h2-12,23,25-27,29,31-37H,13H2,1H3/b9-4+/t23-,25-,26+,27-,29-/m0/s1
InChIKey PFNZPDQSGXBRDK-YANLDYNRSA-N
Mol Weight 584.53 g/mol
Molecular Formula C29H28O13
Exact Mass 584.152991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ETSjjqaFFs
Name 4'-O-(6''-O-GALLOYL-BETA-D-GLUCOPYRANOSYL)-2'-HYDROXY-4-METHOXYCHALCONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H28O13
InChI InChI=1S/C29H28O13/c1-39-16-5-2-14(3-6-16)4-9-19(30)18-8-7-17(12-20(18)31)41-29-27(37)26(36)25(35)23(42-29)13-40-28(38)15-10-21(32)24(34)22(33)11-15/h2-12,23,25-27,29,31-37H,13H2,1H3/b9-4+/t23-,25-,26+,27-,29-/m0/s1
InChIKey PFNZPDQSGXBRDK-YANLDYNRSA-N
Literature Reference Author Z.X.ZHAO,J.JIN,C.Z.LIN,C.C.ZHU,Y.M.LIU,A.H.LIN,Y.X.LIU,L.ZHS MG,H.F.LUO
Literature Reference Citation FITOTERAPIA,82,1102(2011)
Literature Reference DOI 10.1016/j.fitote.2011.07.005
Molecular Weight 584.534 g/mol
Solvent DMSO-D6
Source File Reference UWDB1097