EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:74327 - Ile-Val

ChEBI IDCHEBI:74327
ChEBI NameIle-Val
Stars
DefinitionA dipeptide formed from L-isoleucine and L-valine residues.
Last Modified25 June 2013
SubmitterSteve
DownloadsMolfile
FormulaC11H22N2O3
Net Charge0
Average Mass230.308
Monoisotopic Mass230.16304
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)O)C(C)C
InChIInChI=1S/C11H22N2O3/c1-5-7(4)8(12)10(14)13-9(6(2)3)11(15)16/h6-9H,5,12H2,1-4H3,(H,13,14)(H,15,16)/t7-,8-,9-/m0/s1
InChIKeyBCXBIONYYJCSDF-CIUDSAMLSA-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-Val (CHEBI:74327) has role metabolite (CHEBI:25212)
Ile-Val (CHEBI:74327) is a dipeptide (CHEBI:46761)
IUPAC Name 
L-isoleucyl-L-valine
Synonyms  Source
IVChEBI
L-Ile-L-ValChEBI
isoleucylvalineChEBI
Isoleucyl-ValineHMDB
Manual XrefsDatabases
HMDB0028920HMDB
Registry NumbersSources
Reaxys:4418289Reaxys
CAS:41017-96-3ChemIDplus