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CAS 822-19-5

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β-Calendic acid

Description:
β-Calendic acid is a naturally occurring fatty acid derived from the oil of marigold flowers, specifically from Calendula officinalis. It is classified as a conjugated fatty acid due to the presence of multiple double bonds in its carbon chain, which contributes to its unique chemical properties. The molecular structure of β-calendic acid features a long hydrocarbon chain with a series of cis and trans double bonds, making it an important component in various biological processes. This compound is known for its potential anti-inflammatory and skin-healing properties, which have led to its use in cosmetic formulations and herbal remedies. Additionally, β-calendic acid exhibits a relatively low melting point and is soluble in organic solvents, which enhances its applicability in various formulations. Its CAS number, 822-19-5, is a unique identifier that facilitates the tracking and regulation of this substance in scientific and industrial contexts. Overall, β-calendic acid is valued for its beneficial properties and versatility in both medicinal and cosmetic applications.
Formula:C18H30O2
InChI:InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-11H,2-5,12-17H2,1H3,(H,19,20)/b7-6+,9-8+,11-10+
InChI key:InChIKey=DQGMPXYVZZCNDQ-OBWVEWQSSA-N
SMILES:C(/C=C/C=C/C=C/CCCCC)CCCCCC(O)=O
Synonyms:
  • trans,trans,trans-8,10,12-Octadecatrienoic acid
  • 8,10,12-Octadecatrienoic acid, (8E,10E,12E)-
  • 8,10,12-Octadecatrienoic acid, (E,E,E)-
  • (8E,10E,12E)-8,10,12-Octadecatrienoic acid
  • β-Calendic acid
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