EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:164958 - Tyr-Arg-Glu

ChEBI IDCHEBI:164958
ChEBI NameTyr-Arg-Glu
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30N6O7
Net Charge0
Average Mass466.495
Monoisotopic Mass466.21760
SMILESNC(N)=NCCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIInChI=1S/C20H30N6O7/c21-13(10-11-3-5-12(27)6-4-11)17(30)25-14(2-1-9-24-20(22)23)18(31)26-15(19(32)33)7-8-16(28)29/h3-6,13-15,27H,1-2,7-10,21H2,(H,25,30)(H,26,31)(H,28,29)(H,32,33)(H4,22,23,24)/t13-,14-,15-/m0/s1
InChIKeyHTHCZRWCFXMENJ-KKUMJFAQSA-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-Arg-Glu (CHEBI:164958) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]pentanedioic acid