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CHEBI:27401 - 3-oxopentanoic acid

ChEBI IDCHEBI:27401
ChEBI Name3-oxopentanoic acid
Stars
Secondary ChEBI IDCHEBI:1648
Last Modified6 February 2017
DownloadsMolfile
FormulaC5H8O3
Net Charge0
Average Mass116.116
Monoisotopic Mass116.04734
SMILESCCC(=O)CC(=O)O
InChIInChI=1S/C5H8O3/c1-2-4(6)3-5(7)8/h2-3H2,1H3,(H,7,8)
InChIKeyFHSUFDYFOHSYHI-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)
3-oxopentanoic acid (CHEBI:27401) is a 3-oxo fatty acid (CHEBI:134416)
3-oxopentanoic acid (CHEBI:27401) is a oxopentanoic acid (CHEBI:25799)
3-oxopentanoic acid (CHEBI:27401) is conjugate acid of 3-oxopentanoate (CHEBI:20177)
Incoming Relation(s)
3-oxopentanoate (CHEBI:20177) is conjugate base of 3-oxopentanoic acid (CHEBI:27401)
IUPAC Name 
3-oxopentanoic acid
Synonyms  Source
3-Oxopentanoic acidKEGG COMPOUND
3-oxovaleric acidChEBI
3-OxopentanoateKEGG COMPOUND
Manual XrefsDatabases
C02233KEGG COMPOUND
LMFA01060005LIPID MAPS
Registry NumbersSources
Beilstein:1748703Beilstein