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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > o-acylcarnitine > 3-octadeca-9,12-dienoyloxy-4-(trimethylazaniumyl)butanoate
organooxygen compound > carbonyl compound > carboxylic ester > o-acylcarnitine > 3-octadeca-9,12-dienoyloxy-4-(trimethylazaniumyl)butanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > quaternary nitrogen compound > ammonium betaine > o-acylcarnitine > 3-octadeca-9,12-dienoyloxy-4-(trimethylazaniumyl)butanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > dipolar compound > zwitterion > onium betaine > ammonium betaine > o-acylcarnitine > 3-octadeca-9,12-dienoyloxy-4-(trimethylazaniumyl)butanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > dipolar compound > zwitterion > onium betaine > ammonium betaine > o-acylcarnitine > 3-octadeca-9,12-dienoyloxy-4-(trimethylazaniumyl)butanoate

Preferred term

3-octadeca-9,12-dienoyloxy-4-(trimethylazaniumyl)butanoate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C25H45NO4

inchi

  • InChI=1S/C25H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h9-10,12-13,23H,5-8,11,14-22H2,1-4H3

inchikey

  • MJLXQSQYKZWZCB-UHFFFAOYSA-N

mass

  • 423.638

monoisotopicmass

  • 423.33486

smiles

  • O(C(C[N+](C)(C)C)CC([O-])=O)C(=O)CCCCCCCC=CCC=CCCCCC

subset

  • 2_STAR

synonym EXACT

  • 3-octadeca-9,12-dienoyloxy-4-(trimethylazaniumyl)butanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181891

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