CHEBI:133610 - N-isobutyrylglycinate

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ChEBI Name N-isobutyrylglycinate ChEBI ID CHEBI:133610 ChEBI ASCII Name N-isobutyrylglycinate Definition A monocarboxylic acid anion that is the conjugate base of N-isobutyrylglycine, 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 Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C6H10NO3 Net Charge -1 Average Mass 144.149 Monoisotopic Mass 144.06662 InChI InChI=1S/C6H11NO3/c1-4(2)6(10)7-3-5(8)9/h4H,3H2,1-2H3,(H,7,10)(H,8,9)/p-1 InChIKey DCICDMMXFIELDF-UHFFFAOYSA-M SMILES C(CNC(=O)C(C)C)(=O)[O-] Roles Classification Biological Role(s): human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples. View more via ChEBI Ontology ChEBI Ontology Outgoing N-isobutyrylglycinate (CHEBI:133610) has role human urinary metabolite (CHEBI:84087) N-isobutyrylglycinate (CHEBI:133610) is a N-acylglycinate (CHEBI:57670) N-isobutyrylglycinate (CHEBI:133610) is a monocarboxylic acid anion (CHEBI:35757) N-isobutyrylglycinate (CHEBI:133610) is conjugate base of N-isobutyrylglycine (CHEBI:70979) Incoming N-isobutyrylglycine (CHEBI:70979) is conjugate acid of N-isobutyrylglycinate (CHEBI:133610) IUPAC Name (2-methylpropanamido)acetate Synonyms Sources isobutanoylglycinate ChEBI isobutyrylglycinate ChEBI N-(2-methylpropanoyl)glycinate ChEBI N-isobutanoylglycinate ChEBI Manual Xref Database HMDB0000730 HMDB View more database links Last Modified 12 October 2016