Caffeic Acid 3-β-D-Glucuronide

• CAT Number: R013596
• CAS Number: 1093679-73-2
• Molecular Formula: C15H16O10
• Molecular Weight: 356.28
• Purity: ≥95%
• Synonyms: 5-[(1E)-2-Carboxyethenyl]-2-hydroxyphenyl β-D-Glucopyranosiduronic Acid
• Storage: Store at +4C
• IUPAC Name: (2S,3S,4S,5R,6S)-6-[5-[(E)-2-carboxyethenyl]-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
• InChI: InChI=1S/C15H16O10/c16-7-3-1-6(2-4-9(17)18)5-8(7)24-15-12(21)10(19)11(20)13(25-15)14(22)23/h1-5,10-13,15-16,19-21H,(H,17,18)(H,22,23)/b4-2+/t10-,11-,12+,13-,15+/m0/s1
• InChIKey: BSOMSDFTZKNUHY-ZYZFHZPYSA-N
• SMILES: C1=CC(=C(C=C1C=CC(=O)O)OC2C(C(C(C(O2)C(=O)O)O)O)O)O

Caffeic Acid 3-β-D-Glucuronide(CAT: R013596) is a metabolite of caffeic acid, a phenolic compound found in various fruits, vegetables, and coffee. This glucuronidated form results from the body’s process of detoxifying caffeic acid via glucuronidation, where a glucuronic acid molecule is attached. This modification increases its water solubility, facilitating its excretion. Caffeic Acid 3-β-D-Glucuronide retains some of the antioxidant and anti-inflammatory properties of caffeic acid, making it of interest in studies related to human metabolism, oxidative stress, and inflammation. Its presence in the body is often used as a biomarker for dietary intake of caffeic acid-containing foods and beverages.