N-isobutyrylglycine (CHEBI:70979)

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ChEBI Name	N-isobutyrylglycine

ChEBI ID	CHEBI:70979

ChEBI ASCII Name	N-isobutyrylglycine

Definition	An N-acylglycine in which the acyl group is specified as isobutryl.

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

Supplier Information

Download	Molfile XML SDF

Formula

C6H11NO3

Net Charge

Average Mass

145.15640

Monoisotopic Mass

145.07389

InChI

InChI=1S/C6H11NO3/c1-4(2)6(10)7-3-5(8)9/h4H,3H2,1-2H3,(H,7,10)(H,8,9)

InChIKey

DCICDMMXFIELDF-UHFFFAOYSA-N

SMILES

CC(C)C(=O)NCC(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 urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples.

ChEBI Ontology
Outgoing	N-isobutyrylglycine (CHEBI:70979) has role human urinary metabolite (CHEBI:84087) N-isobutyrylglycine (CHEBI:70979) is a N-acylglycine (CHEBI:16180) N-isobutyrylglycine (CHEBI:70979) is conjugate acid of N-isobutyrylglycinate (CHEBI:133610)

Incoming	N-isobutyrylglycinate (CHEBI:133610) is conjugate base of N-isobutyrylglycine (CHEBI:70979)

IUPAC Names

[(2-methylpropanoyl)amino]acetic acid

N-(2-methylpropanoyl)glycine

Registry Number	Type	Source
1762789	Reaxys Registry Number	Reaxys

Last Modified

12 October 2016