EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:84175 - 2-methylhexadecanoate

ChEBI IDCHEBI:84175
ChEBI Name2-methylhexadecanoate
Stars
DefinitionA 2-methyl fatty acid anion that is the conjugate base of 2-methylhexadecanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified2 March 2015
Submitternhn
DownloadsMolfile
FormulaC17H33O2
Net Charge-1
Average Mass269.449
Monoisotopic Mass269.24860
SMILESCCCCCCCCCCCCCCC(C)C(=O)[O-]
InChIInChI=1S/C17H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)17(18)19/h16H,3-15H2,1-2H3,(H,18,19)/p-1
InChIKeyAXPAUZGVNGEWJD-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
2-methylhexadecanoate (CHEBI:84175) is a 2-methyl fatty acid anion (CHEBI:83976)
2-methylhexadecanoate (CHEBI:84175) is a fatty acid anion 17:0 (CHEBI:78124)
2-methylhexadecanoate (CHEBI:84175) is a long-chain fatty acid anion (CHEBI:57560)
2-methylhexadecanoate (CHEBI:84175) is conjugate base of 2-methylhexadecanoic acid (CHEBI:85057)
Incoming Relation(s)
2-methylhexadecanoic acid (CHEBI:85057) is conjugate acid of 2-methylhexadecanoate (CHEBI:84175)
IUPAC Name 
2-methylhexadecanoate
Synonym  Source
2-methylhexadecanoate(1−)ChEBI
UniProt Name  Source
2-methylhexadecanoateUniProt
Citations