CHEBI:49256 - (S)-2-acetyl-2-hydroxybutanoate

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ChEBI Name (S)-2-acetyl-2-hydroxybutanoate
ChEBI ID CHEBI:49256
ChEBI ASCII Name (S)-2-acetyl-2-hydroxybutanoate
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H9O4
Net Charge -1
Average Mass 145.13326
Monoisotopic Mass 145.050
InChI InChI=1S/C6H10O4/c1-3-6(10,4(2)7)5(8)9/h10H,3H2,1-2H3,(H,8,9)/p-1/t6-/m0/s1
InChIKey VUQLHQFKACOHNZ-LURJTMIESA-M
SMILES CC[C@](O)(C(C)=O)C([O-])=O
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:4932) Source: yeast.sf.net See: PubMed
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
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ChEBI Ontology
Outgoing (S)-2-acetyl-2-hydroxybutanoate (CHEBI:49256) has functional parent butyrate (CHEBI:17968)
(S)-2-acetyl-2-hydroxybutanoate (CHEBI:49256) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
(S)-2-acetyl-2-hydroxybutanoate (CHEBI:49256) is a 3-oxo monocarboxylic acid anion (CHEBI:35973)
(S)-2-acetyl-2-hydroxybutanoate (CHEBI:49256) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
(S)-2-acetyl-2-hydroxybutanoate (CHEBI:49256) is conjugate base of (S)-2-acetyl-2-hydroxybutanoic acid (CHEBI:27681)
Incoming (S)-2-acetyl-2-hydroxybutanoic acid (CHEBI:27681) is conjugate acid of (S)-2-acetyl-2-hydroxybutanoate (CHEBI:49256)
IUPAC Name
(2S)-2-ethyl-2-hydroxy-3-oxobutanoate
Synonyms Sources
(S)-2-Aceto-2-hydroxybutanoate KEGG COMPOUND
(S)-2-acetyl-2-hydroxybutyrate ChEBI
(S)-2-ethyl-2-hydroxy-3-oxobutanoate UniProt
(S)-2-Hydroxy-2-ethyl-3-oxobutanoate KEGG COMPOUND
Database Link Database
C06006 KEGG COMPOUND
View more database links
Registry Number Type Source
3604112 Beilstein Registry Number Beilstein
Last Modified
25 October 2017