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CHEBI:10045 - Wyerone

ChEBI IDCHEBI:10045
ChEBI NameWyerone
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H14O4
Net Charge0
Average Mass258.273
Monoisotopic Mass258.08921
SMILESCC/C=C\C#CC(=O)c1ccc(/C=C/C(=O)OC)o1
InChIInChI=1S/C15H14O4/c1-3-4-5-6-7-13(16)14-10-8-12(19-14)9-11-15(17)18-2/h4-5,8-11H,3H2,1-2H3/b5-4-,11-9+
InChIKeyNQZCQIDFBYCBAU-JHGYFVHDSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Wyerone (CHEBI:10045) is a heterocyclic fatty acid (CHEBI:48847)
Synonym  Source
WyeroneKEGG COMPOUND
Manual XrefsDatabases
C08465KEGG COMPOUND
C00001299KNApSAcK
Registry NumbersSources
CAS:20079-30-5KEGG COMPOUND