2-hydroxy-4-methylvalerate (CHEBI:133577)

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ChEBI Name	2-hydroxy-4-methylvalerate

ChEBI ID	CHEBI:133577

Definition	A 2-hydroxy fatty acid anion that is the conjugate base of 2-hydroxy-4-methylvaleric acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C6H11O3

Net Charge

-1

Average Mass

131.150

Monoisotopic Mass

131.07137

InChI

InChI=1S/C6H12O3/c1-4(2)3-5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/p-1

InChIKey

LVRFTAZAXQPQHI-UHFFFAOYSA-M

SMILES

C(C(C([O-])=O)O)C(C)C

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology
Outgoing	2-hydroxy-4-methylvalerate (CHEBI:133577) has functional parent valeric acid (CHEBI:17418) 2-hydroxy-4-methylvalerate (CHEBI:133577) has role metabolite (CHEBI:25212) 2-hydroxy-4-methylvalerate (CHEBI:133577) is a 2-hydroxy fatty acid anion (CHEBI:76176) 2-hydroxy-4-methylvalerate (CHEBI:133577) is a methyl-branched fatty acid anion (CHEBI:67013) 2-hydroxy-4-methylvalerate (CHEBI:133577) is conjugate base of 2-hydroxy-4-methylvaleric acid (CHEBI:59783)

Incoming	(R)-2-hydroxy-4-methylpentanoate (CHEBI:55535) is a 2-hydroxy-4-methylvalerate (CHEBI:133577) 2-hydroxy-4-methylvaleric acid (CHEBI:59783) is conjugate acid of 2-hydroxy-4-methylvalerate (CHEBI:133577)

IUPAC Name

2-hydroxy-4-methylpentanoate

Registry Number	Type	Source
5729843	Reaxys Registry Number	Reaxys

Last Modified

09 November 2021