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CHEBI:744019 - (S)-2-hydroxy-3-methylbutyrate

ChEBI IDCHEBI:744019
ChEBI Name(S)-2-hydroxy-3-methylbutyrate
Stars
ASCII Name(S)-2-hydroxy-3-methylbutyrate
DefinitionThe S-enantiomer of 2-hydroxy-3-methylbutyrate. The conjugate base of (S)-2-hydroxy-3-methylbutyric acid, formed by loss of a proton from the carboxy group, it is the major species present at physiological pH.
Secondary ChEBI IDCHEBI:606519
Last Modified9 April 2024
DownloadsMolfile
FormulaC5H9O3
Net Charge-1
Average Mass117.124
Monoisotopic Mass117.05572
SMILESCC(C)[C@H](O)C(=O)[O-]
InChIInChI=1S/C5H10O3/c1-3(2)4(6)5(7)8/h3-4,6H,1-2H3,(H,7,8)/p-1/t4-/m0/s1
InChIKeyNGEWQZIDQIYUNV-BYPYZUCNSA-M
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
(S)-2-hydroxy-3-methylbutyrate (CHEBI:744019) has role human metabolite (CHEBI:77746)
(S)-2-hydroxy-3-methylbutyrate (CHEBI:744019) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
(S)-2-hydroxy-3-methylbutyrate (CHEBI:744019) is conjugate base of (S)-2-hydroxy-3-methylbutyric acid (CHEBI:60631)
(S)-2-hydroxy-3-methylbutyrate (CHEBI:744019) is enantiomer of (R)-2-hydroxy-3-methylbutyrate (CHEBI:145660)
Incoming Relation(s)
(S)-2-hydroxy-3-methylbutyric acid (CHEBI:60631) is conjugate acid of (S)-2-hydroxy-3-methylbutyrate (CHEBI:744019)
(R)-2-hydroxy-3-methylbutyrate (CHEBI:145660) is enantiomer of (S)-2-hydroxy-3-methylbutyrate (CHEBI:744019)
Synonyms  Source
(S)-2-hydroxy-3-methylbutanoateChEMBL
2-HydroxyisovalerateChEBI
2-OxyisovalerateChEBI
UniProt Name  Source
(S)-2-hydroxy-3-methylbutanoateUniProt
Citations