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2-BENZYL-4,6DIHYDROXY-BENZOIC-ACID-6-O-[BETA]-D-GLUCOPYRANOSIDE
SpectraBase Compound ID gJ13N2pxGG
InChI InChI=1S/C20H22O9/c21-9-14-16(23)17(24)18(25)20(29-14)28-13-8-12(22)7-11(15(13)19(26)27)6-10-4-2-1-3-5-10/h1-5,7-8,14,16-18,20-25H,6,9H2,(H,26,27)/t14-,16-,17+,18-,20-/m1/s1
InChIKey FMDSCPPQABHNLB-UVNCQSPWSA-N
Mol Weight 406.39 g/mol
Molecular Formula C20H22O9
Exact Mass 406.126382 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DbFhxFL6eql
Name 2-BENZYL-4,6DIHYDROXY-BENZOIC-ACID-6-O-[BETA]-D-GLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22O9
InChI InChI=1S/C20H22O9/c21-9-14-16(23)17(24)18(25)20(29-14)28-13-8-12(22)7-11(15(13)19(26)27)6-10-4-2-1-3-5-10/h1-5,7-8,14,16-18,20-25H,6,9H2,(H,26,27)/t14-,16-,17+,18-,20-/m1/s1
InChIKey FMDSCPPQABHNLB-UVNCQSPWSA-N
Literature Reference Author X.H.WU,J.L.RUAN,C.R.CHENG,Z.Y.WU,S.H.GUAN,S.J.TAO,P.P.XU,D.A .GUO
Literature Reference Citation FITOTERAPIA,81,617(2010)
Literature Reference DOI 10.1016/j.fitote.2010.03.004
Molecular Weight 406.389 g/mol
Solvent DMSO-D6
Source File Reference UWMB1202