CHEBI:49168 - dopa

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ChEBI Name dopa ChEBI ID CHEBI:49168 Definition A hydroxyphenylalanine carrying hydroxy substituents at positions 3 and 4 of the benzene ring. 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 C9H11NO4 Net Charge 0 Average Mass 197.18798 Monoisotopic Mass 197.06881 InChI InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14) InChIKey WTDRDQBEARUVNC-UHFFFAOYSA-N SMILES NC(Cc1ccc(O)c(O)c1)C(O)=O Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) 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). View more via ChEBI Ontology ChEBI Ontology Outgoing dopa (CHEBI:49168) has role human metabolite (CHEBI:77746) dopa (CHEBI:49168) is a hydroxyphenylalanine (CHEBI:24734) dopa (CHEBI:49168) is a non-proteinogenic α-amino acid (CHEBI:83925) dopa (CHEBI:49168) is a tyrosine derivative (CHEBI:62761) Incoming 6-hydroxydopa (CHEBI:20725) has functional parent dopa (CHEBI:49168) N-methyldopa (CHEBI:167648) has functional parent dopa (CHEBI:49168) D-dopa (CHEBI:49169) is a dopa (CHEBI:49168) L-dopa (CHEBI:15765) is a dopa (CHEBI:49168) IUPAC Names 2-amino-3-(3,4-dihydroxyphenyl)propanoic acid dopa Synonyms Sources (±)-3-(3,4-dihydroxyphenyl)alanine ChemIDplus (±)-dopa ChemIDplus (R,S)-dopa ChemIDplus 3',4'-dihydroxyphenylalanine NIST Chemistry WebBook 3-hydroxy-DL-tyrosine ChemIDplus 3-hydroxytyrosine IUPAC β-(3,4-dihydroxyphenyl)-DL-α-alanine NIST Chemistry WebBook DL-3,4-dopa ChemIDplus dl-β-(3,4-dihydroxyphenyl)-α-alanine NIST Chemistry WebBook DL-β-(3,4-dihydroxyphenyl)alanine NIST Chemistry WebBook DL-dihydroxyphenylalanine ChemIDplus DL-dioxyphenylalanine ChemIDplus Manual Xref Database HMDB0000609 HMDB View more database links Registry Numbers Types Sources 1462084 Reaxys Registry Number Reaxys 1462084 Beilstein Registry Number Beilstein 51382 Gmelin Registry Number Gmelin 63-84-3 CAS Registry Number ChemIDplus 63-84-3 CAS Registry Number NIST Chemistry WebBook Citation Type Source 24117106 PubMed citation Europe PMC Last Modified 12 March 2021