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CHEBI:230721 - 6-bromo-eicosa-5e,9z-dienoic acid

Default Structure
ChEBI IDCHEBI:230721
ChEBI Name6-bromo-eicosa-5e,9z-dienoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H35BrO2
Net Charge0
Average Mass387.402
Monoisotopic Mass386.18204
SMILESCCCCCCCCCC/C=C\CC/C(Br)=C\CCCC(=O)O
InChIInChI=1S/C20H35BrO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19(21)17-14-15-18-20(22)23/h11-12,17H,2-10,13-16,18H2,1H3,(H,22,23)/b12-11-,19-17+
InChIKeyKFWIFLAWUCOXPE-DLYFVKKFSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
6-bromo-eicosa-5e,9z-dienoic acid (CHEBI:230721) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
(5E,9Z)-6-bromoicosa-5,9-dienoic acid
Manual XrefsDatabases
113368343ChemSpider
LMFA01090098LIPID MAPS