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CHEBI:158861 - Ile-Tyr-Glu

ChEBI IDCHEBI:158861
ChEBI NameIle-Tyr-Glu
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](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIInChI=1S/C20H29N3O7/c1-3-11(2)17(21)19(28)23-15(10-12-4-6-13(24)7-5-12)18(27)22-14(20(29)30)8-9-16(25)26/h4-7,11,14-15,17,24H,3,8-10,21H2,1-2H3,(H,22,27)(H,23,28)(H,25,26)(H,29,30)/t11-,14-,15-,17-/m0/s1
InChIKeyRMJWFINHACYKJI-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-Tyr-Glu (CHEBI:158861) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanedioic acid