CAS 537-15-5

α-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-3,4-dihydroxybenzenepropanoic acid

Description:

The chemical substance known as α-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-3,4-dihydroxybenzenepropanoic acid, with the CAS number 537-15-5, is a phenolic compound characterized by its complex structure that includes multiple hydroxyl groups and a propanoic acid moiety. This compound exhibits strong antioxidant properties due to the presence of the dihydroxyphenyl groups, which can scavenge free radicals and mitigate oxidative stress. It is soluble in polar solvents, reflecting its ability to form hydrogen bonds, and is likely to have a moderate to high melting point due to its molecular interactions. The compound may also demonstrate biological activity, potentially influencing various metabolic pathways, making it of interest in pharmacological and nutritional research. Its structural features suggest potential applications in food preservation, cosmetics, and therapeutic formulations, particularly in the context of health benefits associated with polyphenolic compounds. Further studies would be necessary to fully elucidate its properties and potential uses.

Formula: C₁₈H₁₆O₈

InChI: InChI=1S/C18H16O8/c19-12-4-1-10(7-14(12)21)3-6-17(23)26-16(18(24)25)9-11-2-5-13(20)15(22)8-11/h1-8,16,19-22H,9H2,(H,24,25)

InChI key: InChIKey=DOUMFZQKYFQNTF-UHFFFAOYSA-N

SMILES: C(C(OC(C=CC1=CC(O)=C(O)C=C1)=O)C(O)=O)C2=CC(O)=C(O)C=C2

Synonyms:

• Lactic acid, 3-(3,4-dihydroxyphenyl)-, 3,4-dihydroxycinnamate
• 3-(3,4-dihydroxyphenyl)-2-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}propanoic acid
• Rosemarinic acid
• Cinnamic acid, 3,4-dihydroxy-, 2-ester with 3-(3,4-dihydroxyphenyl)lactic acid
• α-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-3,4-dihydroxybenzenepropanoic acid
• (2R)-3-(3,4-dihydroxyphenyl)-2-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}propanoic acid
• (R)-alpha-[3-(3,4-Dihydroxyphenyl)-1-oxo-2E-propenyl]oxy-3,4-dihydroxybenzenepropanoic acid
• Benzenepropanoic acid, α-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-3,4-dihydroxy-
• Benzenepropanoic acid, α-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-3,4-dihydroxy-

Rosmarinate

CAS: 537-15-5

Formula: C₁₈H₁₆O₈

Purity: 98%

Color and Shape: Solid

Molecular weight: 360.3148

Ref: IN-DA00ILNE

rosmarinate acid

CAS: 537-15-5

rosmarinate acid

Purity: ≥98%

Molecular weight: 360.31g/mol

Ref: 54-BUP10915

rosmarinate acid

CAS: 537-15-5

Rosmarinate acid(Rosemary acid) inhibits MAO-A, MAO-B and COMT enzymes with IC50s of 50.1, 184.6 and 26.7 μM, respectively

Formula: C₁₈H₁₆O₈

Purity: 99.69%

Color and Shape: Solid

Molecular weight: 360.31

Ref: TM-TN7057