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CHEBI:81660 - 3-Chloro-2-methyldienelactone

ChEBI IDCHEBI:81660
ChEBI Name3-Chloro-2-methyldienelactone
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DownloadsMolfile
FormulaC7H5ClO4
Net Charge0
Average Mass188.566
Monoisotopic Mass187.98764
SMILESCC1=C(Cl)/C(=C/C(=O)O)OC1=O
InChIInChI=1S/C7H5ClO4/c1-3-6(8)4(2-5(9)10)12-7(3)11/h2H,1H3,(H,9,10)/b4-2-
InChIKeyOYEYSZZDZDSDCR-RQOWECAXSA-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)
3-Chloro-2-methyldienelactone (CHEBI:81660) is a halo fatty acid (CHEBI:60692)
Manual XrefsDatabases
C18309KEGG COMPOUND
HMDB0060368HMDB