EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:185841 - (Z)-heptadec-14-en-12-yn-2-one

Default Structure
ChEBI IDCHEBI:185841
ChEBI Name(Z)-heptadec-14-en-12-yn-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H28O
Net Charge0
Average Mass248.410
Monoisotopic Mass248.21402
SMILESCC/C=C\C#CCCCCCCCCCC(C)=O
InChIInChI=1S/C17H28O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)18/h4-5H,3,8-16H2,1-2H3/b5-4-
InChIKeyOXKMRJUGQAGNFL-PLNGDYQASA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
(Z)-heptadec-14-en-12-yn-2-one (CHEBI:185841) is a ketone (CHEBI:17087)
IUPAC Name 
(Z)-heptadec-14-en-12-yn-2-one
Manual XrefsDatabases
113368953ChemSpider
LMFA12000375LIPID MAPS