CAS 132741-56-1

Chlorogenic acid butyl ester

Description:

Chlorogenic acid butyl ester, with the CAS number 132741-56-1, is an ester derivative of chlorogenic acid, which is a naturally occurring compound found in various plants, particularly in coffee beans. This compound is characterized by its potential antioxidant properties, which can help in neutralizing free radicals in biological systems. Chlorogenic acid butyl ester is typically a colorless to pale yellow liquid with a pleasant odor, and it is soluble in organic solvents. Its structure features a butyl group attached to the chlorogenic acid backbone, which may influence its solubility and biological activity compared to its parent compound. This ester is of interest in various fields, including food science and pharmaceuticals, due to its potential health benefits, such as anti-inflammatory and anti-diabetic effects. Additionally, it may be utilized in the formulation of cosmetic products for its skin-protective properties. However, further research is necessary to fully understand its mechanisms of action and potential applications.

Formula: C₂₀H₂₆O₉

InChI: InChI=1S/C20H26O9/c1-2-3-8-28-19(26)20(27)10-15(23)18(25)16(11-20)29-17(24)7-5-12-4-6-13(21)14(22)9-12/h4-7,9,15-16,18,21-23,25,27H,2-3,8,10-11H2,1H3/b7-5+/t15-,16-,18-,20+/m1/s1

InChI key: InChIKey=VNLREARKISTOAD-SNQQTVKYSA-N

SMILES: C(OCCCC)(=O)[C@@]1(O)C[C@@H](OC(/C=C/C2=CC(O)=C(O)C=C2)=O)[C@H](O)[C@H](O)C1

Synonyms:

• Chlorogenic acid butyl ester
• 3-O-Caffeoyl quinic acid butyl ester
• Cyclohexanecarboxylic acid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, butyl ester, [1S-[1α,3β(E),4α,5α]]-
• Cyclohexanecarboxylic acid, 3-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, butyl ester, (1S,3R,4R,5R)-
• Cyclohexanecarboxylic acid, 3-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4,5-trihydroxy-, butyl ester, (1S,3R,4R,5R)-

Butyl chlorogenate

CAS: 132741-56-1

Butyl chlorogenate

Purity: ≥98%

Molecular weight: 410.42g/mol

Ref: 54-BUP09307

Butyl chlorogenate

CAS: 132741-56-1

Butylchlorogenate is a natural compound isolated from Lonicera japonica, Urceola rosea.

Formula: C₂₀H₂₆O₉

Purity: 99.62%

Color and Shape: Soild

Molecular weight: 410.42

Ref: TM-TN7230

Butyl chlorogenate

CAS: 132741-56-1

Formula: C₂₀H₂₆O₉

Purity: 95%~99%

Molecular weight: 410.419

Ref: BP-BP5115