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1-O-3',4',5'-TRIMETHOXYPHENYL-(2,3-DI-O-GALLOYL)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 4SrWyLD33tc
InChI InChI=1S/C29H30O17/c1-40-18-8-13(9-19(41-2)24(18)42-3)43-29-26(46-28(39)12-6-16(33)22(36)17(34)7-12)25(23(37)20(10-30)44-29)45-27(38)11-4-14(31)21(35)15(32)5-11/h4-9,20,23,25-26,29-37H,10H2,1-3H3/t20-,23-,25+,26-,29-/m0/s1
InChIKey XQRHZDSICBATET-ZKYSQGFYSA-N
Mol Weight 650.54 g/mol
Molecular Formula C29H30O17
Exact Mass 650.148299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7awfOYJHZFL
Name 1-O-3',4',5'-TRIMETHOXYPHENYL-(2,3-DI-O-GALLOYL)-BETA-D-GLUCOPYRANOSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H30O17
InChI InChI=1S/C29H30O17/c1-40-18-8-13(9-19(41-2)24(18)42-3)43-29-26(46-28(39)12-6-16(33)22(36)17(34)7-12)25(23(37)20(10-30)44-29)45-27(38)11-4-14(31)21(35)15(32)5-11/h4-9,20,23,25-26,29-37H,10H2,1-3H3/t20-,23-,25+,26-,29-/m0/s1
InChIKey XQRHZDSICBATET-ZKYSQGFYSA-N
Literature Reference Author A.A.MAGID,L.VOUTQUENNE-NAZABADIOKO,D.HARAKAT,C.MORETTI,C.LAV AUD
Literature Reference Citation J.NAT.PROD.,71,914(2008)
Literature Reference DOI 10.1021/np800015p
Molecular Weight 650.547 g/mol
Sample ID 28349
Solvent CD3OD