CHEBI:68561 - N-acetyltyrosine

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ChEBI Name N-acetyltyrosine ChEBI ID CHEBI:68561 ChEBI ASCII Name N-acetyltyrosine Definition An N-acetyl-amino acid that is tyrosine with an amine hydrogen substituted by an acetyl group. 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 C11H13NO4 Net Charge 0 Average Mass 223.22520 Monoisotopic Mass 223.08446 InChI InChI=1S/C11H13NO4/c1-7(13)12-10(11(15)16)6-8-2-4-9(14)5-3-8/h2-5,10,14H,6H2,1H3,(H,12,13)(H,15,16) InChIKey CAHKINHBCWCHCF-UHFFFAOYSA-N SMILES CC(=O)NC(Cc1ccc(O)cc1)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 urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples. View more via ChEBI Ontology ChEBI Ontology Outgoing N-acetyltyrosine (CHEBI:68561) has functional parent tyrosine (CHEBI:18186) N-acetyltyrosine (CHEBI:68561) has role human urinary metabolite (CHEBI:84087) N-acetyltyrosine (CHEBI:68561) is a N-acetyl-amino acid (CHEBI:21575) N-acetyltyrosine (CHEBI:68561) is a phenols (CHEBI:33853) N-acetyltyrosine (CHEBI:68561) is a tyrosine derivative (CHEBI:62761) Incoming N-acetyl-L-tyrosine (CHEBI:21563) is a N-acetyltyrosine (CHEBI:68561) IUPAC Names 2-(acetylamino)-3-(4-hydroxyphenyl)propanoic acid N-acetyltyrosine Synonyms Sources N-acetyl-4-hydroxyphenylalanine HMDB N-acetyl-DL-tyrosine ChEBI Manual Xref Database HMDB0000866 HMDB View more database links Registry Number Type Source 3206104 Reaxys Registry Number Reaxys Citation Type Source 22770225 PubMed citation Europe PMC Last Modified 03 October 2016