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CHEBI:43722 - isomyristic acid

ChEBI IDCHEBI:43722
ChEBI Nameisomyristic acid
Stars
DefinitionA branched-chain saturated fatty acid consisting of tridecanoic acid carrying a 12-methyl group.
Secondary ChEBI IDsCHEBI:39249, CHEBI:43718
Last Modified23 October 2015
Submitterunwin305
DownloadsMolfile
FormulaC14H28O2
Net Charge0
Average Mass228.376
Monoisotopic Mass228.20893
SMILESCC(C)CCCCCCCCCCC(=O)O
InChIInChI=1S/C14H28O2/c1-13(2)11-9-7-5-3-4-6-8-10-12-14(15)16/h13H,3-12H2,1-2H3,(H,15,16)
InChIKeyYYVJAABUJYRQJO-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
isomyristic acid (CHEBI:43722) is a branched-chain saturated fatty acid (CHEBI:39417)
isomyristic acid (CHEBI:43722) is a long-chain fatty acid (CHEBI:15904)
isomyristic acid (CHEBI:43722) is conjugate acid of isomyristate (CHEBI:84193)
Incoming Relation(s)
isomyristoyl-CoA (CHEBI:85077) has functional parent isomyristic acid (CHEBI:43722)
isomyristate (CHEBI:84193) is conjugate base of isomyristic acid (CHEBI:43722)
IUPAC Name 
12-methyltridecanoic acid
Synonyms  Source
aseanostatin P1ChemIDplus
12-methyltridecylic acidLIPID MAPS
12-MethyltridecancarbonsäureChEBI
i14:0ChEBI
12-MethyltridecansäureChEBI
iso-14:0ChEBI
Manual XrefsDatabases
LMFA01020007LIPID MAPS
LNGPDBeChem
Registry NumbersSources
Reaxys:1769697Reaxys
CAS:2724-57-4NIST Chemistry WebBook
CAS:2724-57-4ChemIDplus
Citations