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CHEBI:187760 - 18-bromo-octadecanoic acid

ChEBI IDCHEBI:187760
ChEBI Name18-bromo-octadecanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H35BrO2
Net Charge0
Average Mass363.380
Monoisotopic Mass362.18204
SMILESO=C(O)CCCCCCCCCCCCCCCCCBr
InChIInChI=1S/C18H35BrO2/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(20)21/h1-17H2,(H,20,21)
InChIKeyBSDAIZFMQYOAFY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
18-bromo-octadecanoic acid (CHEBI:187760) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
18-bromooctadecanoic acid
Manual XrefsDatabases
4472373ChemSpider
LMFA01090014LIPID MAPS