Description

[1S-(1Alpha,3Beta,4Beta,5Alpha)]-3-[[3-(3,4-Dihydroxyphenyl)-1-Oxoallyl]Oxy]-1,4,5-Trihydroxycyclohexanecarboxylic Acid is a high-purity, complex polyphenolic compound of significant interest in advanced research and development. This compound matters as a key intermediate or reference standard for synthesizing novel bioactive molecules and studying structure-activity relationships. It is primarily needed by pharmaceutical R&D laboratories, nutraceutical formulators, and academic institutions focused on natural product chemistry and medicinal chemistry.

Application

• Pharmaceutical Research & Development: Serves as a critical intermediate or building block for the synthesis of novel drug candidates with potential antioxidant, anti-inflammatory, or neuroprotective properties.
• Reference Standard for Analytical Chemistry: Used as a high-purity standard in HPLC, LC-MS, and other analytical methods for the identification and quantification of related polyphenolic compounds in complex matrices.
• Nutraceutical and Cosmetic Ingredient Research: Investigated for its potential application in advanced formulations targeting oxidative stress and skin health due to its polyphenolic structure.
• Biochemical Research: Employed in enzymatic and metabolic pathway studies to understand the biological activity and transformation of complex plant-derived polyphenols.
• Organic Synthesis: Acts as a sophisticated chiral starting material or intermediate for the total synthesis of natural products and complex organic molecules.

Basic Information

Product Name	[1S-(1Alpha,3Beta,4Beta,5Alpha)]-3-[[3-(3,4-Dihydroxyphenyl)-1-Oxoallyl]Oxy]-1,4,5-Trihydroxycyclohexanecarboxylic Acid
CAS No.	534-61-2
Molecular Formula	C16H18O9
Molecular Weight	354.31 g/mol
Synonyms	1,4,5-Trihydroxy-3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]cyclohexanecarboxylic Acid; 3-O-Caffeoylquinic Acid (specific isomer); 3-CQA; 3-O-Caffeoyl-1,4,5-trihydroxycyclohexanecarboxylic Acid; Caffeoylquinic Acid Isomer; Chlorogenic Acid Related Compound; Cyclohexanecarboxylic acid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, [1S-(1α,3β,4β,5α)]-
EINECS	208-579-8

Quality Control

Our [1S-(1Alpha,3Beta,4Beta,5Alpha)]-3-[[3-(3,4-Dihydroxyphenyl)-1-Oxoallyl]Oxy]-1,4,5-Trihydroxycyclohexanecarboxylic Acid is produced and handled under strict quality management protocols. Each batch undergoes rigorous analytical testing, including HPLC for purity and identity confirmation via spectroscopic methods, to ensure it meets the high standards required for research and development applications. A comprehensive Certificate of Analysis (COA) detailing purity, assay, and impurity profiles is provided with every shipment.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry place at a controlled room temperature (15-25°C). Due to its sensitivity to light and susceptibility to oxidation, long-term storage under an inert atmosphere (e.g., nitrogen or argon) is recommended for optimal stability. Keep the container tightly sealed in a dry environment to minimize exposure to moisture.

Specification

Item	Specification
Appearance	White to off-white powder
Identification (IR)	Conforms to structure
Identification (HPLC)	Retention time matches reference standard
Purity (HPLC)	≥ 95.0%
Assay	≥ 97.0% (on dried basis)
Loss on Drying	≤ 2.0%
Residue on Ignition	≤ 0.5%
Heavy Metals	≤ 20 ppm

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.