CHEBI:50129 - 2-hydroxyisobutyric acid

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ChEBI Name 2-hydroxyisobutyric acid ChEBI ID CHEBI:50129 Definition A 2-hydroxy monocarboxylic acid that is isobutyric acid bearing a hydroxy substituent at position 2. It is a metabolite of methyl tertiary-butyl ether. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C4H8O3 Net Charge 0 Average Mass 104.10450 Monoisotopic Mass 104.04734 InChI InChI=1S/C4H8O3/c1-4(2,7)3(5)6/h7H,1-2H3,(H,5,6) InChIKey BWLBGMIXKSTLSX-UHFFFAOYSA-N SMILES CC(C)(O)C(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. View more via ChEBI Ontology ChEBI Ontology Outgoing 2-hydroxyisobutyric acid (CHEBI:50129) has functional parent isobutyric acid (CHEBI:16135) 2-hydroxyisobutyric acid (CHEBI:50129) has role human xenobiotic metabolite (CHEBI:76967) 2-hydroxyisobutyric acid (CHEBI:50129) is a 2-hydroxy monocarboxylic acid (CHEBI:49302) 2-hydroxyisobutyric acid (CHEBI:50129) is conjugate acid of 2-hydroxyisobutyrate (CHEBI:19641) Incoming 1,30-diacetyltrichagmalin F (CHEBI:68369) has functional parent 2-hydroxyisobutyric acid (CHEBI:50129) 30-acetyltrichagmalin F (CHEBI:68368) has functional parent 2-hydroxyisobutyric acid (CHEBI:50129) trichagmalin F (CHEBI:68367) has functional parent 2-hydroxyisobutyric acid (CHEBI:50129) 2-hydroxyisobutyrate (CHEBI:19641) is conjugate base of 2-hydroxyisobutyric acid (CHEBI:50129) IUPAC Name 2-hydroxy-2-methylpropanoic acid Synonyms Sources 2-Hydroxy-2-methylpropionic acid ChemIDplus 2-Hydroxy-2-methylpropionsäure ChEBI 2-Hydroxyisobutyric acid ChemIDplus 2-methyl-2-hydroxypropanoic acid ChEBI 2-Methyl-2-hydroxypropionsäure ChEBI 2-Methyllactic acid ChemIDplus Acetonic acid ChemIDplus acide 2-hydroxy-2-méthylpropanoïque ChEBI ácido 2-hidroxi-2-metilpropionico ChEBI α-hydroxy-α-methylpropanoic acid ChEBI α-hydroxy-α-methylpropionic acid HMDB α-hydroxyisobutanoic acid HMDB α-hydroxyisobutyric acid NIST Chemistry WebBook HIBA HMDB Hydroxydimethylacetic acid HMDB Manual Xrefs Databases HMDB0000729 HMDB WO2009135074 Patent View more database links Registry Numbers Types Sources 1744739 Beilstein Registry Number Beilstein 1744739 Reaxys Registry Number Reaxys 594-61-6 CAS Registry Number NIST Chemistry WebBook 594-61-6 CAS Registry Number ChemIDplus Citations Types Sources 12563344 PubMed citation Europe PMC 12775515 PubMed citation Europe PMC 17190852 PubMed citation Europe PMC 20184738 PubMed citation Europe PMC Last Modified 23 October 2015