EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:166041 - Tyr-Val-Glu

ChEBI IDCHEBI:166041
ChEBI NameTyr-Val-Glu
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H27N3O7
Net Charge0
Average Mass409.439
Monoisotopic Mass409.18490
SMILESCC(C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIInChI=1S/C19H27N3O7/c1-10(2)16(18(27)21-14(19(28)29)7-8-15(24)25)22-17(26)13(20)9-11-3-5-12(23)6-4-11/h3-6,10,13-14,16,23H,7-9,20H2,1-2H3,(H,21,27)(H,22,26)(H,24,25)(H,28,29)/t13-,14-,16-/m0/s1
InChIKeyPQPWEALFTLKSEB-DZKIICNBSA-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-Val-Glu (CHEBI:166041) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]pentanedioic acid