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CHEBI:63864 - 4,8-dimethylnonanoic acid

ChEBI IDCHEBI:63864
ChEBI Name4,8-dimethylnonanoic acid
Stars
DefinitionA medium-chain fatty acid, nonanoic acid with methyl branches at C-4 and C-8.
Last Modified31 January 2014
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC11H22O2
Net Charge0
Average Mass186.295
Monoisotopic Mass186.16198
SMILESCC(C)CCCC(C)CCC(=O)O
InChIInChI=1S/C11H22O2/c1-9(2)5-4-6-10(3)7-8-11(12)13/h9-10H,4-8H2,1-3H3,(H,12,13)
InChIKeyVZPIUNDOWLDCTC-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)
4,8-dimethylnonanoic acid (CHEBI:63864) is a branched-chain fatty acid (CHEBI:35819)
4,8-dimethylnonanoic acid (CHEBI:63864) is a medium-chain fatty acid (CHEBI:59554)
4,8-dimethylnonanoic acid (CHEBI:63864) is conjugate acid of 4,8-dimethylnonanoate (CHEBI:77063)
Incoming Relation(s)
(R)-4,8-dimethylnonanoylcarnitine (CHEBI:84654) has functional parent 4,8-dimethylnonanoic acid (CHEBI:63864)
4,8-dimethylnonanoyl-CoA (CHEBI:63856) has functional parent 4,8-dimethylnonanoic acid (CHEBI:63864)
4,8-dimethylnonanoate (CHEBI:77063) is conjugate base of 4,8-dimethylnonanoic acid (CHEBI:63864)
IUPAC Name 
4,8-dimethylnonanoic acid
Synonym  Source
4,8-dimethyl-nonanoic acidLIPID MAPS
Manual XrefsDatabases
LMFA01020288LIPID MAPS
Registry NumbersSources
Reaxys:1722883Reaxys