CHEBI:62413 - (S)-methylmalonate semialdehyde

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ChEBI Name (S)-methylmalonate semialdehyde ChEBI ID CHEBI:62413 ChEBI ASCII Name (S)-methylmalonate semialdehyde Definition 2-Methyl-3-oxopropanoate with S configuration at the chiral centre. Stars This entity has been manually annotated by the ChEBI Team. Submitter Eugeni Belda Supplier Information No supplier information found for this compound. Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C4H5O3 Net Charge -1 Average Mass 101.08070 Monoisotopic Mass 101.02442 InChI InChI=1S/C4H6O3/c1-3(2-5)4(6)7/h2-3H,1H3,(H,6,7)/p-1/t3-/m0/s1 InChIKey VOKUMXABRRXHAR-VKHMYHEASA-M SMILES C[C@@H](C=O)C([O-])=O Roles Classification Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). (via 2-methyl-3-oxopropanoate ) View more via ChEBI Ontology ChEBI Ontology Outgoing (S)-methylmalonate semialdehyde (CHEBI:62413) is a 2-methyl-3-oxopropanoate (CHEBI:57700) (S)-methylmalonate semialdehyde (CHEBI:62413) is conjugate base of (S)-methylmalonaldehydic acid (CHEBI:27821) (S)-methylmalonate semialdehyde (CHEBI:62413) is enantiomer of (R)-methylmalonate semialdehyde (CHEBI:141212) Incoming (S)-methylmalonaldehydic acid (CHEBI:27821) is conjugate acid of (S)-methylmalonate semialdehyde (CHEBI:62413) (R)-methylmalonate semialdehyde (CHEBI:141212) is enantiomer of (S)-methylmalonate semialdehyde (CHEBI:62413) IUPAC Name (2S)-2-methyl-3-oxopropanoate Synonyms Sources (S)-2-methyl-3-oxopropanoate UniProt (S)-2-methyl-3-oxopropanoate (1−) SUBMITTER (S)-ch3-malonate-semialdehyde (1−) SUBMITTER (S)-Me-malonate-semialdehyde(1−) ChEBI Manual Xref Database CH3-MALONATE-S-ALD MetaCyc View more database links Last Modified 11 July 2023