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CHEBI:77197 - isotridecanoate

ChEBI IDCHEBI:77197
ChEBI Nameisotridecanoate
Stars
DefinitionA methyl-branched fatty acid anion that is the conjugate base of isotridecanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified18 February 2014
Submitterlaimo
DownloadsMolfile
FormulaC13H25O2
Net Charge-1
Average Mass213.341
Monoisotopic Mass213.18600
SMILESCC(C)CCCCCCCCCC(=O)[O-]
InChIInChI=1S/C13H26O2/c1-12(2)10-8-6-4-3-5-7-9-11-13(14)15/h12H,3-11H2,1-2H3,(H,14,15)/p-1
InChIKeySIOLDWZBFABPJU-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
isotridecanoate (CHEBI:77197) is a methyl-branched fatty acid anion (CHEBI:67013)
isotridecanoate (CHEBI:77197) is conjugate base of isotridecanoic acid (CHEBI:77359)
Incoming Relation(s)
isotridecanoic acid (CHEBI:77359) is conjugate acid of isotridecanoate (CHEBI:77197)
IUPAC Name 
11-methyldodecanoate
Synonyms  Source
11-methyldodecylateSUBMITTER
11-methyllaurateSUBMITTER
isotridecylateSUBMITTER
UniProt Name  Source
11-methyldodecanoateUniProt