EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:82957 - 3-hydroxyisovalerate

ChEBI IDCHEBI:82957
ChEBI Name3-hydroxyisovalerate
Stars
DefinitionA hydroxy monocarboxylic acid anion that is the conjugate base of 3-hydroxyisovaleric acid.
Last Modified16 September 2014
Submitternamrata
DownloadsMolfile
FormulaC5H9O3
Net Charge-1
Average Mass117.124
Monoisotopic Mass117.05572
SMILESCC(C)(O)CC(=O)[O-]
InChIInChI=1S/C5H10O3/c1-5(2,8)3-4(6)7/h8H,3H2,1-2H3,(H,6,7)/p-1
InChIKeyAXFYFNCPONWUHW-UHFFFAOYSA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (21886157)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
3-hydroxyisovalerate (CHEBI:82957) has role human metabolite (CHEBI:77746)
3-hydroxyisovalerate (CHEBI:82957) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
3-hydroxyisovalerate (CHEBI:82957) is conjugate base of 3-hydroxyisovaleric acid (CHEBI:37084)
Incoming Relation(s)
3-hydroxyisovaleric acid (CHEBI:37084) is conjugate acid of 3-hydroxyisovalerate (CHEBI:82957)
IUPAC Name 
3-hydroxy-3-methylbutanoate
Synonyms  Source
3-hydroxy-3-methylbutyrateChEBI
β-hydroxyisovalerateChEBI