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CHEBI:10046 - Wyerone acid

ChEBI IDCHEBI:10046
ChEBI NameWyerone acid
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC14H12O4
Net Charge0
Average Mass244.246
Monoisotopic Mass244.07356
SMILESCC/C=C\C#CC(=O)c1ccc(/C=C/C(=O)O)o1
InChIInChI=1S/C14H12O4/c1-2-3-4-5-6-12(15)13-9-7-11(18-13)8-10-14(16)17/h3-4,7-10H,2H2,1H3,(H,16,17)/b4-3-,10-8+
InChIKeyZLZFXXJOALTVDA-JWAQTBJPSA-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 acid (CHEBI:10046) is a heterocyclic fatty acid (CHEBI:48847)
Synonym  Source
Wyerone acidKEGG COMPOUND
Manual XrefsDatabases
C08466KEGG COMPOUND
C00001300KNApSAcK
Registry NumbersSources
CAS:54954-14-2KEGG COMPOUND