CHEBI:64669 - 2-hydroxy-3-methylbutyrate

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ChEBI Name 2-hydroxy-3-methylbutyrate
ChEBI ID CHEBI:64669
Definition A hydroxy monocarboxylic acid anion that is the conjugate base of 2-hydroxy-3-methylbutyric acid, formed by loss of a proton from the carboxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB7399440, eMolecules:484241, ZINC000000084153
Download Molfile XML SDF
Formula C5H9O3
Net Charge -1
Average Mass 117.12320
Monoisotopic Mass 117.05572
InChI InChI=1S/C5H10O3/c1-3(2)4(6)5(7)8/h3-4,6H,1-2H3,(H,7,8)/p-1
InChIKey NGEWQZIDQIYUNV-UHFFFAOYSA-M
SMILES CC(C)C(O)C([O-])=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: PubMed
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-hydroxy-3-methylbutyrate (CHEBI:64669) has role human metabolite (CHEBI:77746)
2-hydroxy-3-methylbutyrate (CHEBI:64669) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
2-hydroxy-3-methylbutyrate (CHEBI:64669) is conjugate base of 2-hydroxy-3-methylbutyric acid (CHEBI:60645)
Incoming 2-hydroxy-3-methylbutyric acid (CHEBI:60645) is conjugate acid of 2-hydroxy-3-methylbutyrate (CHEBI:64669)
IUPAC Name
2-hydroxy-3-methylbutanoate
Synonyms Sources
2-Hydroxy-3-methylbutyrate HMDB
2-Hydroxyisopentanoate HMDB
2-Hydroxyisovalerate HMDB
2-Oxyisovalerate HMDB
3-Methyl-2-hydroxybutyrate HMDB
A-hydroxyisovalerate HMDB
alpha-hydroxyisovalerate HMDB
α-hydroxyisovalerate ChEBI
DL-2-Hydroxy-3-methylbutanoate HMDB
DL-2-Hydroxyisovalerate HMDB
DL-a-hydroxyisovalerate HMDB
DL-alpha-hydroxyisovalerate HMDB
DL-α-hydroxyisovalerate ChEBI
Manual Xref Database
HMDB0000407 HMDB
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Registry Number Type Source
5728855 Reaxys Registry Number Reaxys
Citation Type Source
17190852 PubMed citation Europe PMC
Last Modified
16 September 2014