EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:15792 - malonate(2−)

ChEBI IDCHEBI:15792
ChEBI Namemalonate(2−)
Stars
ASCII Namemalonate(2-)
DefinitionA dicarboxylic acid dianion obtained by the deprotonation of the carboxy groups of malonic acid.
Secondary ChEBI IDsCHEBI:14563, CHEBI:25130, CHEBI:44151
Last Modified16 September 2021
DownloadsMolfile

FormulaC3H2O4
Net Charge-2
Average Mass102.045
Monoisotopic Mass101.99641
SMILESO=C([O-])CC(=O)[O-]
InChIInChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)/p-2
InChIKeyOFOBLEOULBTSOW-UHFFFAOYSA-L

Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (23111923)
Roles Classification

ChEBI Ontology
IUPAC Name 
propanedioate
Synonyms  Source
maloIUPAC
MALONATE IONPDBeChem
malonic acid, ion(2−)ChemIDplus
propanedioic acid, ion(2−)ChemIDplus
−OOC‒CH2‒COO−ChEBI
UniProt Name  Source
malonateUniProt
Manual XrefsDatabases
C00383KEGG COMPOUND
MLIPDBeChem
DB02201DrugBank
Registry NumbersSources
Gmelin:141932Gmelin
Reaxys:3904386Reaxys
CAS:156-80-9ChemIDplus