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CHEBI:228965 - 2-(Buta-1,3-diynyl)-5-(but-3-en-1-ynyl) thiophene

Default Structure
ChEBI IDCHEBI:228965
ChEBI Name2-(Buta-1,3-diynyl)-5-(but-3-en-1-ynyl) thiophene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H6S
Net Charge0
Average Mass182.247
Monoisotopic Mass182.01902
SMILESC#CC#Cc1ccc(C#CC=C)s1
InChIInChI=1S/C12H6S/c1-3-5-7-11-9-10-12(13-11)8-6-4-2/h1,4,9-10H,2H2
InChIKeyQVLQCDBLHFENOC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
2-(Buta-1,3-diynyl)-5-(but-3-en-1-ynyl) thiophene (CHEBI:228965) is a thiophenes (CHEBI:26961)
IUPAC Name 
2-buta-1,3-diynyl-5-but-3-en-1-ynylthiophene
Manual XrefsDatabases
4474837ChemSpider