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4,5-Di-O-caffeoylquinic acid methyl ester

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4,5-Di-O-caffeoylquinic acid methyl ester Basic information
Product Name:4,5-Di-O-caffeoylquinic acid methyl ester
Synonyms:4,5-Di-O-caffeoylquinic acid methyl ester;Cyclohexanecarboxylic acid, 3,4-bis[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,5-dihydroxy-, methyl ester, (1R,3R,4S,5R)-;4,5-O-Dicaffeoyl quinic acid methyl ester
CAS:188742-80-5
MF:C26H26O12
MW:530.48
EINECS:
Product Categories:
Mol File:188742-80-5.mol
4,5-Di-O-caffeoylquinic acid methyl ester Structure
4,5-Di-O-caffeoylquinic acid methyl ester Chemical Properties
Boiling point 740.7±60.0 °C(Predicted)
density 1.56±0.1 g/cm3(Predicted)
storage temp. -20°C
pka9.32±0.10(Predicted)
form solid
biological sourceplant
Major Applicationmetabolomics
vitamins, nutraceuticals, and natural products
InChIKeyPKJBSZTYNDRXEQ-GMGOHGFSSA-N
SMILESO([C@@H]2[C@@H](C[C@@](C[C@H]2O)(O)C(=O)OC)OC(=O)\C=C\c3cc(c(cc3)O)O)C(=O)\C=C\c1cc(c(cc1)O)O
Safety Information
WGK Germany WGK 3
Storage Class11 - Combustible Solids
MSDS Information
4,5-Di-O-caffeoylquinic acid methyl ester Usage And Synthesis
UsesIt is a natural product derived from plant source th at finds application in compound screening libraries, metabolomics, phytochemical, and pharmaceutical research.
Biological Activity4,5-Di-O-caffeoylquinic acid methyl ester demonstrates strong antioxidant activity with significant free radical-scavenging abilities against DPPH. Additionally, it displays in vitro antiviral activity against the respiratory syncytial virus.
4,5-Di-O-caffeoylquinic acid methyl ester Preparation Products And Raw materials
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