2-ethylhydracrylic acid (CHEBI:82956)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	2-ethylhydracrylic acid

ChEBI ID	CHEBI:82956

Definition	A branched-chain saturated fatty acid that is butanoic acid substituted by a hydroxymethyl group at position 2. It is a metabolite derived from the isoleucine metabolism.

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

Supplier Information

Download	Molfile XML SDF

Formula

C5H10O3

Net Charge

Average Mass

118.13110

Monoisotopic Mass

118.06299

InChI

InChI=1S/C5H10O3/c1-2-4(3-6)5(7)8/h4,6H,2-3H2,1H3,(H,7,8)

InChIKey

ZMZQVAUJTDKQGE-UHFFFAOYSA-N

SMILES

CCC(CO)C(O)=O

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	See: PubMed

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 metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).

ChEBI Ontology
Outgoing	2-ethylhydracrylic acid (CHEBI:82956) has role human metabolite (CHEBI:77746) 2-ethylhydracrylic acid (CHEBI:82956) is a branched-chain saturated fatty acid (CHEBI:39417) 2-ethylhydracrylic acid (CHEBI:82956) is a hydroxy fatty acid (CHEBI:24654) 2-ethylhydracrylic acid (CHEBI:82956) is a short-chain fatty acid (CHEBI:26666) 2-ethylhydracrylic acid (CHEBI:82956) is conjugate acid of 2-ethylhydracrylate (CHEBI:82955)

Incoming	2-ethylhydracrylate (CHEBI:82955) is conjugate base of 2-ethylhydracrylic acid (CHEBI:82956)

IUPAC Name

2-(hydroxymethyl)butanoic acid

Synonyms	Sources
2-(Hydroxymethyl)-Butyric acid	HMDB
2-Ethylhydracrylic acid	HMDB
3-Hydroxy-2-ethylpropanoic acid	HMDB
beta-Hydroxy-alpha-ethylpropionic acid	HMDB

Last Modified

23 October 2015