EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:180435 - Anapear

ChEBI IDCHEBI:180435
ChEBI NameAnapear
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H14O2
Net Charge0
Average Mass154.209
Monoisotopic Mass154.09938
SMILESC=CC/C=C/CCC(=O)OC
InChIInChI=1S/C9H14O2/c1-3-4-5-6-7-8-9(10)11-2/h3,5-6H,1,4,7-8H2,2H3/b6-5+
InChIKeyWUNJOFRDOLDAOY-AATRIKPKSA-N
ChEBI Ontology
Outgoing Relation(s)
Anapear (CHEBI:180435) is a fatty acid methyl ester (CHEBI:4986)
IUPAC Name 
methyl (4E)-octa-4,7-dienoate
Manual XrefsDatabases
9161662ChemSpider
HMDB0040285HMDB
Registry NumbersSources
CAS:189440-77-5ChemIDplus