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CHEBI:174252 - Elenaic acid

Default Structure
ChEBI IDCHEBI:174252
ChEBI NameElenaic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O6
Net Charge0
Average Mass242.227
Monoisotopic Mass242.07904
SMILESCOC(=O)C1=COC(C)C(C=O)C1CC(=O)O
InChIInChI=1S/C11H14O6/c1-6-8(4-12)7(3-10(13)14)9(5-17-6)11(15)16-2/h4-8H,3H2,1-2H3,(H,13,14)
InChIKeyMQFAJBBHEYTHKF-UHFFFAOYSA-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)
Elenaic acid (CHEBI:174252) is a dicarboxylic acid (CHEBI:35692)
IUPAC Name 
2-(3-ormyl-5-methoxycarbonyl-2-methyl-3,4-dihydro-2H-pyran-4-yl)acetic acid
Manual XrefsDatabases
163618ChemSpider
HMDB0039136HMDB