CHEBI:15604 - (3R)-β-leucine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (3R)-β-leucine
ChEBI ID CHEBI:15604
ChEBI ASCII Name (3R)-beta-leucine
Definition The (3R)-β-isomer of leucine.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:10884, CHEBI:205, CHEBI:21252
Supplier Information
Download Molfile XML SDF
Formula C6H13NO2
Net Charge 0
Average Mass 131.17296
Monoisotopic Mass 131.095
InChI InChI=1S/C6H13NO2/c1-4(2)5(7)3-6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m1/s1
InChIKey GLUJNGJDHCTUJY-RXMQYKEDSA-N
SMILES CC(C)[C@H](N)CC(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 metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via beta-leucine )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (3R)-β-leucine (CHEBI:15604) is a β-leucine (CHEBI:72772)
(3R)-β-leucine (CHEBI:15604) is enantiomer of (3S)-β-leucine (CHEBI:86261)
(3R)-β-leucine (CHEBI:15604) is tautomer of (3R)-β-leucine zwitterion (CHEBI:57428)
Incoming (3S)-β-leucine (CHEBI:86261) is enantiomer of (3R)-β-leucine (CHEBI:15604)
(3R)-β-leucine zwitterion (CHEBI:57428) is tautomer of (3R)-β-leucine (CHEBI:15604)
IUPAC Name
(3R)-3-amino-4-methylpentanoic acid
Synonyms Sources
(3R)-3-Amino-4-methylpentanoic acid KEGG COMPOUND
(3R)-3-Amino-4-methylvaleric acid ChEBI
(3R)-3-Amino-4-methylvaleric acid KEGG COMPOUND
(3R)-beta-2-amino-4-methylvaleric acid ChEBI
(3R)-beta-leucine ChEBI
(3R)-beta-Leucine KEGG COMPOUND
L-beta-Leucine KEGG COMPOUND
Database Links Databases
C02486 KEGG COMPOUND
CPD-2041 MetaCyc
View more database links
Registry Numbers Types Sources
1721066 Reaxys Registry Number Reaxys
5699-54-7 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
3356699 PubMed citation Europe PMC
Last Modified
01 July 2015