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1,3-DI-O-(3,4-BIS-(3,4-DIHYDROXYPHENYL)-CYClOBUTANE-1,2-DICARBONYL)-4,5-DI-O-CAFFEOYLQUINIC-ACID
SpectraBase Compound ID IQxreN3qNHD
InChI InChI=1S/C43H36O18/c44-23-7-1-19(13-27(23)48)3-11-33(52)58-31-17-43(42(56)57)18-32(39(31)60-34(53)12-4-20-2-8-24(45)28(49)14-20)59-40(54)37-35(21-5-9-25(46)29(50)15-21)36(38(37)41(55)61-43)22-6-10-26(47)30(51)16-22/h1-16,31-32,35-39,44-51H,17-18H2,(H,56,57)/b11-3+,12-4+/t31-,32+,35?,36?,37?,38?,39-,43+/m0/s1
InChIKey AYNWTILKWXURJB-CHODKNIZSA-N
Mol Weight 840.7 g/mol
Molecular Formula C43H36O18
Exact Mass 840.190164 g/mol
Enantiomer InChIKey AYNWTILKWXURJB-PBYWEUGGSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Title Journal or Book Year
Caffeoylquinic Acids and Some Biological Activities ofPluchea symphytifolia Planta Medica 1994

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