EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:39251 - 12-methyltetradecanoic acid

ChEBI IDCHEBI:39251
ChEBI Name12-methyltetradecanoic acid
Stars
DefinitionA branched-chain saturated fatty acid comprising tetradecanoic acid carrying a 12-methyl substituent.
Last Modified23 October 2023
Submitterunwin305
DownloadsMolfile

FormulaC15H30O2
Net Charge0
Average Mass242.403
Monoisotopic Mass242.22458
SMILESCCC(C)CCCCCCCCCCC(=O)O
InChIInChI=1S/C15H30O2/c1-3-14(2)12-10-8-6-4-5-7-9-11-13-15(16)17/h14H,3-13H2,1-2H3,(H,16,17)
InChIKeyXKLJLHAPJBUBNL-UHFFFAOYSA-N

Roles Classification

ChEBI Ontology
IUPAC Name 
12-methyltetradecanoic acid
Synonyms  Source
aseanostatin P5ChemIDplus
sarcinic acidLIPID MAPS
C15:0aiChEBI
15:0aiChEBI
12-Methyl-tetradecansäure  deChEBI
12-Methyltetradecansäure  deChEBI
Manual XrefsDatabases
LMFA01020008LIPID MAPS
C16665KEGG COMPOUND
Registry NumbersSources
Reaxys:1723971Reaxys
CAS:5502-94-3ChemIDplus
Citations