EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:193377 - 3-methyl-hexadecanedioic acid

ChEBI IDCHEBI:193377
ChEBI Name3-methyl-hexadecanedioic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H32O4
Net Charge0
Average Mass300.439
Monoisotopic Mass300.23006
SMILESCC(CCCCCCCCCCCCC(=O)O)CC(=O)O
InChIInChI=1S/C17H32O4/c1-15(14-17(20)21)12-10-8-6-4-2-3-5-7-9-11-13-16(18)19/h15H,2-14H2,1H3,(H,18,19)(H,20,21)
InChIKeyRMCPRRDMUKXQID-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-methyl-hexadecanedioic acid (CHEBI:193377) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
3-methylhexadecanedioic acid
Manual XrefsDatabases
7822614ChemSpider
LMFA01170024LIPID MAPS