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(1S,3R,4R,5R)-3,4-BIS-([(E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-OXY)-1,5-DIHYDROXYCYCLOHEXANECARBOXYLIC-ACID

Compound with spectra: 1 NMR

(1S,3R,4R,5R)-3,4-BIS-([(E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-OXY)-1,5-DIHYDROXYCYCLOHEXANECARBOXYLIC-ACID
SpectraBase Compound ID 268QWp7eqjQ
InChI InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)/b7-3+,8-4+/t19-,20+,23-,25+/m1/s1
InChIKey UFCLZKMFXSILNL-BVZNTSJQSA-N
Mol Weight 516.46 g/mol
Molecular Formula C25H24O12
Exact Mass 516.126776 g/mol
Enantiomer InChIKey UFCLZKMFXSILNL-GFGKLCIMSA-N

View Spectrum of (1S,3R,4R,5R)-3,4-BIS-([(E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-OXY)-1,5-DIHYDROXYCYCLOHEXANECARBOXYLIC-ACID

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
(1S,3R,4S,5R)-3,4-BIS-([(E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-OXY)-1,5-DIHYDROXYCYCLOHEXANECARBOXYLIC-ACID
4,5-O-DICAFFEOYLQUINIC-ACID
4,5-DI-O-CAFFEOYLQUINIC-ACID
4,5-O-DICAFFEOYLQUINIC-ACID
3,4-DI-O-CAFFEOYL-QUINIC-ACID
IRBIC-ACID;3,5-DICAFFEOYL-4-O-MALONYLQUINIC-ACID
2-Nitrochlorogenic acid
1,3,5-TRI-O-CAFFEOYL-QUINIC-ACID
1-ISOBUTYRYL-3,5-DICAFFEOYLQUINIC-ACID
3,4,5-TRI-O-GALLOYLQUINIC-ACID
3-O-[3,4-(DIMETHOXY)-CINNAMOYL]-1,5-GAMMA-QUINIDE
(1S,2R,4R,6R,8S)-4-(methoxycarbonyl)-8-phenyl-7,9-dioxabicyclo[4.3.0]nonane-2,4-diol
DUNALIANOSIDE-E;4'-O-ACETYL-6'-O-TRANS-CAFFEOYL-BETA-D-GLUCOPYRANOSIDE
BACOPASIDE-B;3,4-DIHYDROXYPHENYLETHYL-ALCOHOL-(2-O-FERULOYL)-BETA-D-GLUCOPYRANOSIDE
Title Journal or Book Year
Cyclohexanecarboxylic-Acid Derivatives fromPsiadia trinervia Helvetica Chimica Acta 1992
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