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CHEBI:172101 - (E,E,E)-1,3,5,11-Tridecatetraene-7,9-diyne

ChEBI IDCHEBI:172101
ChEBI Name(E,E,E)-1,3,5,11-Tridecatetraene-7,9-diyne
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H12
Net Charge0
Average Mass168.239
Monoisotopic Mass168.09390
SMILESC=C/C=C/C=C/C#CC#C/C=C/C
InChIInChI=1S/C13H12/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-7,9,11H,1H2,2H3/b6-4+,7-5+,11-9+
InChIKeyASVIELUINMCNMW-FSNIPRKGSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
(E,E,E)-1,3,5,11-Tridecatetraene-7,9-diyne (CHEBI:172101) is a enyne (CHEBI:59831)
IUPAC Name 
(3E,5E,11E)-trideca-1,3,5,11-tetraen-7,9-diyne
Manual XrefsDatabases
4509555ChemSpider
Registry NumbersSources
CAS:17091-00-8ChemIDplus