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CHEBI:27821 - (S)-methylmalonaldehydic acid

ChEBI IDCHEBI:27821
ChEBI Name(S)-methylmalonaldehydic acid
Stars
ASCII Name(S)-methylmalonaldehydic acid
DefinitionA 2-methyl-3-oxopropanoic acid that has S-configuration.
Secondary ChEBI IDsCHEBI:427, CHEBI:18789
Last Modified23 June 2022
DownloadsMolfile
FormulaC4H6O3
Net Charge0
Average Mass102.089
Monoisotopic Mass102.03169
SMILESC[C@@H](C=O)C(=O)O
InChIInChI=1S/C4H6O3/c1-3(2-5)4(6)7/h2-3H,1H3,(H,6,7)/t3-/m0/s1
InChIKeyVOKUMXABRRXHAR-VKHMYHEASA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
(S)-methylmalonaldehydic acid (CHEBI:27821) has functional parent propionic acid (CHEBI:30768)
(S)-methylmalonaldehydic acid (CHEBI:27821) has role mouse metabolite (CHEBI:75771)
(S)-methylmalonaldehydic acid (CHEBI:27821) is a 2-methyl-3-oxopropanoic acid (CHEBI:16256)
(S)-methylmalonaldehydic acid (CHEBI:27821) is a aldehydic acid (CHEBI:26643)
(S)-methylmalonaldehydic acid (CHEBI:27821) is conjugate acid of (S)-methylmalonate semialdehyde (CHEBI:62413)
Incoming Relation(s)
(S)-methylmalonate semialdehyde (CHEBI:62413) is conjugate base of (S)-methylmalonaldehydic acid (CHEBI:27821)
IUPAC Name 
(2S)-2-methyl-3-oxopropanoic acid
Synonym  Source
(S)-Methylmalonate semialdehydeKEGG COMPOUND
Manual XrefsDatabases
C06002KEGG COMPOUND
Registry NumbersSources
Beilstein:4364493Beilstein