EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:197814 - Agrocybyne C

ChEBI IDCHEBI:197814
ChEBI NameAgrocybyne C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H7NO
Net Charge0
Average Mass133.150
Monoisotopic Mass133.05276
SMILESC/C=C\C#CC#CC(N)=O
InChIInChI=1S/C8H7NO/c1-2-3-4-5-6-7-8(9)10/h2-3H,1H3,(H2,9,10)/b3-2-
InChIKeyKEFOHTQURAOQPL-IHWYPQMZSA-N
Species of MetaboliteComponentSourceComments
Agrocybe praecox (ncbitaxon:71668) - DOI (10.1016/j.tet.2011.11.049)
ChEBI Ontology
Outgoing Relation(s)
Agrocybyne C (CHEBI:197814) is a carboxamide (CHEBI:37622)
IUPAC Name 
(Z)-oct-6-en-2,4-diynamide
Manual XrefsDatabases
78434602ChemSpider