935565

4-O-p-Coumaroylquinic acid

• Synonym(s): (1α,3R,4α,5R)-1,3,5-Trihydroxy-4-[[3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]cyclohexanecarboxylic acid, 4-Coumaroylquinic acid, Cyclohexanecarboxylic acid, 1,3,5-trihydroxy-4-[[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]oxy]-, (1α,3R,4α,5R)-, Cyclohexanecarboxylic acid, 1,3,5-trihydroxy-4-[[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]oxy]-, [1R-(1α,3α,4α,5β)]-
• Empirical Formula (Hill Notation): C₁₆H₁₈O₈
• CAS Number: 53539-37-0
• Molecular Weight: 338.31
• UNSPSC Code: 12352201
• NACRES: NA.21

Properties

• form: solid
• Quality Level: 100
• bp: 641.9 °C
• density: 1.55 g/cm³
• storage temp.: 2-8°C
• SMILES string: [C@@]1(C[C@H]([C@H]([C@@H](C1)O)OC(=O)/C=C/c1ccc(cc1)O)O)(O)C(=O)O
• InChI: InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(20)24-14-11(18)7-16(23,15(21)22)8-12(14)19/h1-6,11-12,14,17-19,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16-/m1/s1

Description

Application

4-p-Coumaroylquinic acid has garnered attention in pharmaceutical and nutraceutical industries due to its potential therapeutic applications.

Features and Benefits

4-p-Coumaroylquinic acid is a natural phenolic compound that belongs to the class of hydroxycinnamic acid derivatives. It is characterized by the presence of a coumaric acid moiety attached to the quinic acid backbone via an ester linkage. This compound is commonly found in various plant sources, including fruits, vegetables, and coffee, and exhibits antioxidant, anti-inflammatory, and antimicrobial properties.

Safety Information

• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable