CAS 123483-19-2

3-O-Caffeoylquinic acid methyl ester

Description:

3-O-Caffeoylquinic acid methyl ester, with the CAS number 123483-19-2, is a naturally occurring phenolic compound derived from the esterification of caffeoylquinic acid. This compound is characterized by its structural features, which include a quinic acid backbone with a caffeoyl group attached at the 3-position and a methyl ester functional group. It exhibits antioxidant properties, which are attributed to the presence of the caffeoyl moiety, making it of interest in various fields, including food science and pharmacology. The compound is soluble in organic solvents and has limited solubility in water, which influences its bioavailability and potential applications. Additionally, it may contribute to the health benefits associated with the consumption of certain plants, particularly in traditional herbal medicine. Its stability and reactivity can be influenced by environmental factors such as pH and temperature, which are important considerations in both research and practical applications. Overall, 3-O-Caffeoylquinic acid methyl ester represents a significant compound in the study of natural products and their potential health benefits.

Formula: C₁₇H₂₀O₉

InChI: InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1

InChI key: InChIKey=MZNIJRAPCCELQX-AWOKGZDASA-N

SMILES: C(OC)(=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:

• 3-O-Caffeoylquinic acid methyl ester
• Cyclohexanecarboxylic acid, 3-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, methyl ester, (1S,3R,4R,5R)-
• (E)-Chlorogenic acid methyl ester
• Cyclohexanecarboxylic acid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, methyl ester, [1S-[1α,3β(E),4α,5α]]-
• Cyclohexanecarboxylic acid, 3-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4,5-trihydroxy-, methyl ester, (1S,3R,4R,5R)-
• Chlorogenic acid methylester
• 3-caffeoylquinic acid methyl ester
• 3-O-Caffeoylquinic acid methyl,Methyl chlorogenate

Chlorogenic acid methylester

CAS: 123483-19-2

Chlorogenic acid methylester analytical standard provided with chromatographic purity, to be used as reference material for qualitative determination.

Formula: C₁₇H₂₀O₉

Purity: (HPLC) ≥95%

Color and Shape: Powder

Molecular weight: 368.34

Ref: 11-4996

3-O-Caffeoylquinic acid methyl ester

CAS: 123483-19-2

Formula: C₁₇H₂₀O₉

Purity: 98%

Molecular weight: 368.3353

Ref: IN-DA009GOD

3-O-Caffeoylquinic acid methyl ester

CAS: 123483-19-2

3-O-Caffeoylquinic acid methyl ester

Purity: ≥98%

Molecular weight: 368.34g/mol

Ref: 54-BUP00608

3-O-Caffeoylquinic acid methyl ester

CAS: 123483-19-2

Formula: C₁₇H₂₀O₉

Molecular weight: 368.34

Ref: 7W-GY9014

3-O-Caffeoylquinic acid methyl ester

CAS: 123483-19-2

Formula: C₁₇H₂₀O₉

Purity: 95%~99%

Molecular weight: 368.338

Ref: BP-BPF2573

3-O-Caffeoylquinic acid methyl ester

CAS: 123483-19-2

3-O-Caffeoylquinic acid methyl ester is a natural product from Morus alba L.

Formula: C₁₇H₂₀O₉

Purity: 99.57% - 99.78%

Color and Shape: Solid

Molecular weight: 368.34

Ref: TM-TN1261

3-O-Caffeoylquinic Acid Methyl Ester

Controlled Product

CAS: 123483-19-2

Formula: C₁₇H₂₀O₉

Color and Shape: Neat

Molecular weight: 368.335

Ref: TR-O215110

3-O-Caffeoylquinic acid methyl ester

CAS: 123483-19-2

3-O-Caffeoylquinic acid methyl ester is a methyl ester derivative of chlorogenic acid, which is a polyphenolic compound commonly found in various plant species. This esterification enhances its solubility and stability compared to the parent compound. The compound is typically derived from natural sources such as coffee beans, artichokes, and various other fruits and vegetables.

Formula: C₁₆H₁₈O₉CH₂

Purity: Min. 95%

Molecular weight: 368.34 g/mol

Ref: 3D-FC177959