EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:157977 - Ala-Arg-Tyr

ChEBI IDCHEBI:157977
ChEBI NameAla-Arg-Tyr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28N6O5
Net Charge0
Average Mass408.459
Monoisotopic Mass408.21212
SMILESC[C@H](N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C18H28N6O5/c1-10(19)15(26)23-13(3-2-8-22-18(20)21)16(27)24-14(17(28)29)9-11-4-6-12(25)7-5-11/h4-7,10,13-14,25H,2-3,8-9,19H2,1H3,(H,23,26)(H,24,27)(H,28,29)(H4,20,21,22)/t10-,13-,14-/m0/s1
InChIKeyWYPUMLRSQMKIJU-BPNCWPANSA-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)
Ala-Arg-Tyr (CHEBI:157977) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid