EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:214598 - Cyclo(Ala-Ile)

ChEBI IDCHEBI:214598
ChEBI NameCyclo(Ala-Ile)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H16N2O2
Net Charge0
Average Mass184.239
Monoisotopic Mass184.12118
SMILESCC[C@H](C)[C@@H]1NC(=O)[C@H](C)NC1=O
InChIInChI=1S/C9H16N2O2/c1-4-5(2)7-9(13)10-6(3)8(12)11-7/h5-7H,4H2,1-3H3,(H,10,13)(H,11,12)/t5-,6-,7-/m0/s1
InChIKeyJDRIJDPCYNFZIT-ACZMJKKPSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (15522437)
ChEBI Ontology
Outgoing Relation(s)
Cyclo(Ala-Ile) (CHEBI:214598) has functional parent α-amino acid (CHEBI:33704)
Cyclo(Ala-Ile) (CHEBI:214598) is a organonitrogen compound (CHEBI:35352)
Cyclo(Ala-Ile) (CHEBI:214598) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(3S,6S)-3-[(2S)-butan-2-yl]-6-methylpiperazine-2,5-dione
Manual XrefsDatabases
57464908ChemSpider