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CHEBI:164998 - Tyr-Asp-Glu

ChEBI IDCHEBI:164998
ChEBI NameTyr-Asp-Glu
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H23N3O9
Net Charge0
Average Mass425.394
Monoisotopic Mass425.14343
SMILESN[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIInChI=1S/C18H23N3O9/c19-11(7-9-1-3-10(22)4-2-9)16(27)21-13(8-15(25)26)17(28)20-12(18(29)30)5-6-14(23)24/h1-4,11-13,22H,5-8,19H2,(H,20,28)(H,21,27)(H,23,24)(H,25,26)(H,29,30)/t11-,12-,13-/m0/s1
InChIKeyYGKVNUAKYPGORG-AVGNSLFASA-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)
Tyr-Asp-Glu (CHEBI:164998) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-carboxypropanoyl]amino]pentanedioic acid