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CHEBI:74067 - Ile-Ile

ChEBI IDCHEBI:74067
ChEBI NameIle-Ile
Stars
DefinitionA dipeptide formed from two L-isoleucine residues.
Last Modified23 March 2016
SubmitterSteve
DownloadsMolfile
FormulaC12H24N2O3
Net Charge0
Average Mass244.335
Monoisotopic Mass244.17869
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)O)[C@@H](C)CC
InChIInChI=1S/C12H24N2O3/c1-5-7(3)9(13)11(15)14-10(12(16)17)8(4)6-2/h7-10H,5-6,13H2,1-4H3,(H,14,15)(H,16,17)/t7-,8-,9-,10-/m0/s1
InChIKeyBCVIOZZGJNOEQS-XKNYDFJKSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) saliva (UBERON:0001836) PubMed (22308371)
Mycoplasma genitalium (ncbitaxon:2097) - PubMed (22817898)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
Mycoplasma genitalium metabolite  Any bacterial metabolite produced during a metabolic reaction in Mycoplasma genitalium.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
Ile-Ile (CHEBI:74067) has functional parent L-isoleucine (CHEBI:17191)
Ile-Ile (CHEBI:74067) has role Mycoplasma genitalium metabolite (CHEBI:131604)
Ile-Ile (CHEBI:74067) has role human metabolite (CHEBI:77746)
Ile-Ile (CHEBI:74067) is a dipeptide (CHEBI:46761)
IUPAC Name 
L-isoleucyl-L-isoleucine
Synonyms  Source
isoleucylisoleucineChEBI
L-Ile-L-IleChEBI
IIChEBI
Isoleucyl-IsoleucineHMDB
Manual XrefsDatabases
HMDB0028910HMDB
Registry NumbersSources
Reaxys:6314474Reaxys