CHEBI:16934 - 3-cyano-L-alanine

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 3-cyano-L-alanine ChEBI ID CHEBI:16934 ChEBI ASCII Name 3-cyano-L-alanine Definition A cyanoamino acid that is the 3-cyano-derivative of L-alanine. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:19989, CHEBI:11772, CHEBI:11773, CHEBI:1477, CHEBI:13061 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formulae C4H6N2O2 C4H6N2O2 Net Charge 0 Average Mass 114.10260 Monoisotopic Mass 114.04293 InChI InChI=1S/C4H6N2O2/c5-2-1-3(6)4(7)8/h3H,1,6H2,(H,7,8)/t3-/m0/s1 InChIKey BXRLWGXPSRYJDZ-VKHMYHEASA-N SMILES N[C@@H](CC#N)C(O)=O Metabolite of Species Details Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed Homo sapiens (NCBI:txid9606) See: DOI 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): Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). View more via ChEBI Ontology ChEBI Ontology Outgoing 3-cyano-L-alanine (CHEBI:16934) has role Escherichia coli metabolite (CHEBI:76971) 3-cyano-L-alanine (CHEBI:16934) has role human metabolite (CHEBI:77746) 3-cyano-L-alanine (CHEBI:16934) has role mouse metabolite (CHEBI:75771) 3-cyano-L-alanine (CHEBI:16934) is a cyanoamino acid (CHEBI:60974) 3-cyano-L-alanine (CHEBI:16934) is a non-proteinogenic L-α-amino acid (CHEBI:83822) 3-cyano-L-alanine (CHEBI:16934) is conjugate acid of 3-cyano-L-alaninate (CHEBI:57954) 3-cyano-L-alanine (CHEBI:16934) is tautomer of 3-cyano-L-alanine zwitterion (CHEBI:77860) Incoming γ-glutamyl-β-cyanoalanine (CHEBI:10565) has functional parent 3-cyano-L-alanine (CHEBI:16934) 3-cyano-L-alaninate (CHEBI:57954) is conjugate base of 3-cyano-L-alanine (CHEBI:16934) 3-cyano-L-alanine zwitterion (CHEBI:77860) is tautomer of 3-cyano-L-alanine (CHEBI:16934) IUPAC Name 3-cyano-L-alanine Synonyms Sources 3-Cyano-L-alanine KEGG COMPOUND L-3-Cyanoalanine KEGG COMPOUND L-beta-Cyanoalanine KEGG COMPOUND Manual Xrefs Databases C00001350 KNApSAcK C02512 KEGG COMPOUND CPD-603 MetaCyc View more database links Registry Numbers Types Sources 2410688 Reaxys Registry Number Reaxys 6232-19-5 CAS Registry Number KEGG COMPOUND 6232-19-5 CAS Registry Number ChemIDplus Citation Type Source 1855644 PubMed citation Europe PMC Last Modified 27 January 2016