CHEBI:30794 - malonic acid

ChEBI IDCHEBI:30794
ChEBI Namemalonic acid
Stars
DefinitionAn α,ω-dicarboxylic acid in which the two carboxy groups are separated by a single methylene group.
Secondary ChEBI IDsCHEBI:6660, CHEBI:25132, CHEBI:44060
Last Modified18 April 2024
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC3H4O4
Net Charge0
Average Mass104.061
Monoisotopic Mass104.01096
SMILESO=C(O)CC(=O)O
InChIInChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)
InChIKeyOFOBLEOULBTSOW-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
malonic acid (CHEBI:30794) has role human metabolite (CHEBI:77746)
malonic acid (CHEBI:30794) is a α,ω-dicarboxylic acid (CHEBI:28383)
malonic acid (CHEBI:30794) is conjugate acid of malonate(1−) (CHEBI:30795)
Incoming Relation(s)
N-malonyltryptophan (CHEBI:142268) has functional parent malonic acid (CHEBI:30794)
O-malonyl-D-carnitine (CHEBI:86047) has functional parent malonic acid (CHEBI:30794)
O-malonyl-L-carnitine (CHEBI:85470) has functional parent malonic acid (CHEBI:30794)
O-malonylcarnitine (CHEBI:73028) has functional parent malonic acid (CHEBI:30794)
S-malonyl-4'-phosphopantetheine (CHEBI:132976) has functional parent malonic acid (CHEBI:30794)
3-(benzyloxy)-3-oxopropanoic acid (CHEBI:84093) has functional parent malonic acid (CHEBI:30794)
3-oxo-3-ureidopropanoic acid (CHEBI:49049) has functional parent malonic acid (CHEBI:30794)
aminomalonic acid (CHEBI:17475) has functional parent malonic acid (CHEBI:30794)
bumadizone (CHEBI:76119) has functional parent malonic acid (CHEBI:30794)
elesclomol (CHEBI:79369) has functional parent malonic acid (CHEBI:30794)
ethylmalonic acid (CHEBI:741548) has functional parent malonic acid (CHEBI:30794)
heptylmalonic acid (CHEBI:70747) has functional parent malonic acid (CHEBI:30794)
hydroxymalonic acid (CHEBI:16513) has functional parent malonic acid (CHEBI:30794)
isoprothiolane (CHEBI:6047) has functional parent malonic acid (CHEBI:30794)
malonamide (CHEBI:48537) has functional parent malonic acid (CHEBI:30794)
malonate ester (CHEBI:38083) has functional parent malonic acid (CHEBI:30794)
malonyl-CoA methyl ester (CHEBI:71244) has functional parent malonic acid (CHEBI:30794)
methylmalonic acid (CHEBI:30860) has functional parent malonic acid (CHEBI:30794)
oxomalonic acid (CHEBI:30842) has functional parent malonic acid (CHEBI:30794)
malonate(1−) (CHEBI:30795) is conjugate base of malonic acid (CHEBI:30794)
carboxyacetyl group (CHEBI:50650) is substituent group from malonic acid (CHEBI:30794)
malonyl group (CHEBI:25134) is substituent group from malonic acid (CHEBI:30794)
IUPAC Name 
propanedioic acid
Synonyms  Source
HOOC‒CH2‒COOHIUPAC
H2maloIUPAC
Malonic acidKEGG COMPOUND
MALONIC ACIDPDBeChem
Propanedioic acidKEGG COMPOUND
Manual XrefsDatabases
C00001193KNApSAcK
C00383KEGG COMPOUND
DB02175DrugBank
HMDB0000691HMDB
LMFA01170041LIPID MAPS
MALONATEMetaCyc
Malonic_acidWikipedia
MLAPDBeChem
Registry NumbersSources
Reaxys:1751370Reaxys
Gmelin:2550Gmelin
CAS:141-82-2KEGG COMPOUND
CAS:141-82-2ChemIDplus
CAS:141-82-2NIST Chemistry WebBook
Citations