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CHEBI:73520 - Ile-His

ChEBI IDCHEBI:73520
ChEBI NameIle-His
Stars
DefinitionA dipeptide composed of L-isoleucine and L-histidine joined by a peptide linkage.
Last Modified11 June 2013
Submittermwilliams
DownloadsMolfile
FormulaC12H20N4O3
Net Charge0
Average Mass268.317
Monoisotopic Mass268.15354
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1cncn1)C(=O)O
InChIInChI=1S/C12H20N4O3/c1-3-7(2)10(13)11(17)16-9(12(18)19)4-8-5-14-6-15-8/h5-7,9-10H,3-4,13H2,1-2H3,(H,14,15)(H,16,17)(H,18,19)/t7-,9-,10-/m0/s1
InChIKeyQNBYCZTZNOVDMI-HGNGGELXSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Ile-His (CHEBI:73520) has functional parent L-histidine (CHEBI:15971)
Ile-His (CHEBI:73520) has functional parent L-isoleucine (CHEBI:17191)
Ile-His (CHEBI:73520) has role metabolite (CHEBI:25212)
Ile-His (CHEBI:73520) is a dipeptide (CHEBI:46761)
IUPAC Name 
L-isoleucyl-L-histidine
Synonyms  Source
L-Ile-L-HisChEBI
Isoleucyl-HistidineChEBI
IHChEBI
isoleucylhistidineChEBI
Manual XrefsDatabases
HMDB0028909HMDB
Registry NumbersSources
Reaxys:8426200Reaxys