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CHEBI:229848 - 3,3-dibromo-2-n-hexylacrylic acid

ChEBI IDCHEBI:229848
ChEBI Name3,3-dibromo-2-n-hexylacrylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H14Br2O2
Net Charge0
Average Mass314.017
Monoisotopic Mass311.93605
SMILESCCCCCCC(C(=O)O)=C(Br)Br
InChIInChI=1S/C9H14Br2O2/c1-2-3-4-5-6-7(8(10)11)9(12)13/h2-6H2,1H3,(H,12,13)
InChIKeyMFKDPSRYICTYKE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3,3-dibromo-2-n-hexylacrylic acid (CHEBI:229848) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name 
2-(dibromomethylidene)octanoic acid
Manual XrefsDatabases
113368337ChemSpider
LMFA01090083LIPID MAPS