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CHEBI:136711 - N-oleoyl-L-isoleucine

ChEBI IDCHEBI:136711
ChEBI NameN-oleoyl-L-isoleucine
Stars
ASCII NameN-oleoyl-L-isoleucine
DefinitionAn L-isoleucine derivative resulting from the formal condensation of the carboxy group of oleic acid with the amino group of L-isoleucine.
Last Modified27 June 2017
SubmitterSteve
DownloadsMolfile
FormulaC24H45NO3
Net Charge0
Average Mass395.628
Monoisotopic Mass395.33994
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)N[C@H](C(=O)O)[C@@H](C)CC
InChIInChI=1S/C24H45NO3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(26)25-23(24(27)28)21(3)5-2/h12-13,21,23H,4-11,14-20H2,1-3H3,(H,25,26)(H,27,28)/b13-12-/t21-,23-/m0/s1
InChIKeyTYWACVZIFBZIQZ-BSFUXZNJSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
N-oleoyl-L-isoleucine (CHEBI:136711) has functional parent oleic acid (CHEBI:16196)
N-oleoyl-L-isoleucine (CHEBI:136711) is a N-(fatty acyl)-L-α-amino acid (CHEBI:137550)
N-oleoyl-L-isoleucine (CHEBI:136711) is a L-isoleucine derivative (CHEBI:84111)
N-oleoyl-L-isoleucine (CHEBI:136711) is conjugate acid of N-oleoyl-L-isoleucinate (CHEBI:134121)
Incoming Relation(s)
N-oleoyl-L-isoleucinate (CHEBI:134121) is conjugate base of N-oleoyl-L-isoleucine (CHEBI:136711)
IUPAC Name 
N-[(9Z)-octadec-9-enoyl]-L-isoleucine
Synonyms  Source
N-[(9Z)-octadecenoyl]-L-isoleucineChEBI
N-[(9Z)-octadecenoyl]isoleucineChEBI
N-(9Z-octadecenoyl)-L-isoleucineChEBI
N-oleoylisoleucineChEBI
oleoylisoleucineChEBI
N-(9Z-octadecenoyl)isoleucineChEBI
Manual XrefsDatabases
LMFA08020113LIPID MAPS
Registry NumbersSources
Reaxys:20745805Reaxys