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Application Area
Environmental
Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

Clinical diagnostic
Clinical diagnostic

In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.

Organic Chemistry
Organic Chemistry

Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.

Metabolic Research
Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

Caffeic Acid-[13C3]

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General Information
Catalog: BLP-011824
CAS: 1185245-82-2
Molecular Formula: C6[13C]3H8O4
Molecular Weight: 183.14
Chemical Structure
Caffeic Acid-[13C3]
Description Caffeic Acid-[13C3] is the labelled analogue of Caffeic acid. Caffeic Acid is an orally bioavailable, hydroxycinnamic acid derivative and polyphenol, with potential anti-oxidant, anti-inflammatory, and antineoplastic activities. Upon administration, caffeic acid acts as an antioxidant and prevents oxidative stress, thereby preventing DNA damage induced by free radicals.
Synonyms Caffeic Acid-13C3; 3-(3,4-Dihydroxyphenyl)-2-propenoic Acid-13C3; 3,4-Dihydroxycinnamic Acid-13C3; 3,4-Dihydroxybenzeneacrylic Acid-13C3; 4-(2-Carboxyethenyl)-1,2-dihydroxybenzene-13C3; NSC 57197-13C3
IUPAC Name (E)-3-(3,4-dihydroxyphenyl)(1,2,3-13C3)prop-2-enoic acid
Related CAS 331-39-5 (unlabelled)
Canonical SMILES C1=CC(=C(C=C1[13CH]=[13CH][13C](=O)O)O)O
InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+/i2+1,4+1,9+1
InChI Key QAIPRVGONGVQAS-JDWYZSDHSA-N
Melting Point >185°C (dec.)
Purity ≥97% by HPLC; ≥99% atom 13C
Solubility Soluble in DMSO (Sparingly), Methanol (Slightly)
Appearance Dark Grey to Very Dark Brown Solid
Storage Store at -20°C under inert atmosphere
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