CHEBI:72772 - β-leucine

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ChEBI Name β-leucine ChEBI ID CHEBI:72772 ChEBI ASCII Name beta-leucine Definition A β-amino acid that is pentanoic acid substituted at positions 3 and 4 by amino and methyl groups respectively. 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 C6H13NO2 Net Charge 0 Average Mass 131.17290 Monoisotopic Mass 131.09463 InChI InChI=1S/C6H13NO2/c1-4(2)5(7)3-6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9) InChIKey GLUJNGJDHCTUJY-UHFFFAOYSA-N SMILES CC(C)C(N)CC(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 β-leucine (CHEBI:72772) has role human metabolite (CHEBI:77746) β-leucine (CHEBI:72772) is a β-amino acid (CHEBI:33706) Incoming (3R)-β-leucine (CHEBI:15604) is a β-leucine (CHEBI:72772) (3S)-β-leucine (CHEBI:86261) is a β-leucine (CHEBI:72772) IUPAC Name 3-amino-4-methylpentanoic acid Registry Numbers Types Sources 1721067 Reaxys Registry Number Reaxys 5699-54-7 CAS Registry Number ChemIDplus Citation Type Source 23078175 PubMed citation Europe PMC Last Modified 16 July 2015