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3-O-(2'',3''-DIGALLOYL)-BETA-D-GALACTOPYRANOSIDE

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3-O-(2'',3''-DIGALLOYL)-BETA-D-GALACTOPYRANOSIDE
SpectraBase Compound ID 8ShTH6EF52M
InChI InChI=1S/C35H28O21/c36-9-22-27(48)30(54-33(50)11-3-17(41)25(46)18(42)4-11)32(55-34(51)12-5-19(43)26(47)20(44)6-12)35(53-22)56-31-28(49)23-14(38)7-13(37)8-21(23)52-29(31)10-1-15(39)24(45)16(40)2-10/h1-8,22,27,30,32,35-48H,9H2/t22-,27+,30+,32-,35+/m0/s1
InChIKey MSLKOXHXUYQONE-HNDGNKEJSA-N
Mol Weight 784.6 g/mol
Molecular Formula C35H28O21
Exact Mass 784.112308 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HX8KeodrOHb
Name 3-O-(2'',3''-DIGALLOYL)-BETA-D-GALACTOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H28O21
InChI InChI=1S/C35H28O21/c36-9-22-27(48)30(54-33(50)11-3-17(41)25(46)18(42)4-11)32(55-34(51)12-5-19(43)26(47)20(44)6-12)35(53-22)56-31-28(49)23-14(38)7-13(37)8-21(23)52-29(31)10-1-15(39)24(45)16(40)2-10/h1-8,22,27,30,32,35-48H,9H2/t22-,27+,30+,32-,35+/m0/s1
InChIKey MSLKOXHXUYQONE-HNDGNKEJSA-N
Literature Reference Author Z.G.YANG,L.N.JIA,Y.SHEAN,A.OHMURA,S.KITANAKA
Literature Reference Citation MOLECULES,16,8305(2011)
Literature Reference DOI 10.3390/molecules16108305
Molecular Weight 784.595 g/mol
Sample ID 301
Solvent CD3OD