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CHEBI:158406 - Ile-Glu-Tyr

ChEBI IDCHEBI:158406
ChEBI NameIle-Glu-Tyr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H29N3O7
Net Charge0
Average Mass423.466
Monoisotopic Mass423.20055
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C20H29N3O7/c1-3-11(2)17(21)19(28)22-14(8-9-16(25)26)18(27)23-15(20(29)30)10-12-4-6-13(24)7-5-12/h4-7,11,14-15,17,24H,3,8-10,21H2,1-2H3,(H,22,28)(H,23,27)(H,25,26)(H,29,30)/t11-,14-,15-,17-/m0/s1
InChIKeyJXMSHKFPDIUYGS-SIUGBPQLSA-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-Tyr (CHEBI:158406) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-5-[[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]amino]-5-oxopentanoic acid