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CHEBI:158372 - Ile-Glu-Arg

ChEBI IDCHEBI:158372
ChEBI NameIle-Glu-Arg
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H32N6O6
Net Charge0
Average Mass416.479
Monoisotopic Mass416.23833
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O
InChIInChI=1S/C17H32N6O6/c1-3-9(2)13(18)15(27)22-10(6-7-12(24)25)14(26)23-11(16(28)29)5-4-8-21-17(19)20/h9-11,13H,3-8,18H2,1-2H3,(H,22,27)(H,23,26)(H,24,25)(H,28,29)(H4,19,20,21)/t9-,10-,11-,13-/m0/s1
InChIKeyJDAWAWXGAUZPNJ-ZPFDUUQYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Ile-Glu-Arg (CHEBI:158372) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-5-[[(1S)-1-carboxy-4-(diaminomethylideneamino)butyl]amino]-5-oxopentanoic acid
Manual XrefsDatabases
16571974ChemSpider