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CAS 331-39-5

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Caffeic acid

Description:
Caffeic acid is a naturally occurring organic compound classified as a phenolic acid, with the CAS number 331-39-5. It is characterized by its aromatic structure, featuring a hydroxyl group and a carboxylic acid group, which contribute to its chemical reactivity and biological activity. Caffeic acid is commonly found in various plants, particularly in coffee, fruits, and vegetables, and is known for its antioxidant properties. It exhibits a range of biological activities, including anti-inflammatory, antimicrobial, and potential anticancer effects, making it of interest in both nutrition and pharmacology. The compound is soluble in water and organic solvents, which facilitates its extraction from plant materials. Caffeic acid can undergo various chemical reactions, such as esterification and oxidation, leading to the formation of derivatives that may enhance its bioactivity. Its role in plant metabolism and its potential health benefits have made it a subject of extensive research in the fields of biochemistry and nutrition.
Formula:C9H8O4
InChI:InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)
InChI key:InChIKey=QAIPRVGONGVQAS-UHFFFAOYSA-N
SMILES:C(=CC(O)=O)C1=CC(O)=C(O)C=C1
Synonyms:
  • (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
  • (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid
  • (2Z)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid
  • 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-
  • 3,4-Dihydroxybenzeneacrylic acid
  • 3,4-Dihydroxyzimtsaure
  • 3-(3,4-Dihydroxyphenyl)-2-propenoic acid
  • 3-(3,4-Dihydroxyphenyl)Prop-2-Enoic Acid
  • 3-(3,4-Dihydroxyphenyl)propenoic acid
  • 4-(2'-Carboxyvinyl)-1,2-dihydroxybenzene
  • See more synonyms
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