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CHEBI:161001 - Asp-Tyr-Gly

ChEBI IDCHEBI:161001
ChEBI NameAsp-Tyr-Gly
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H19N3O7
Net Charge0
Average Mass353.331
Monoisotopic Mass353.12230
SMILESN[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O
InChIInChI=1S/C15H19N3O7/c16-10(6-12(20)21)14(24)18-11(15(25)17-7-13(22)23)5-8-1-3-9(19)4-2-8/h1-4,10-11,19H,5-7,16H2,(H,17,25)(H,18,24)(H,20,21)(H,22,23)/t10-,11-/m0/s1
InChIKeyAWPWHMVCSISSQK-QWRGUYRKSA-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)
Asp-Tyr-Gly (CHEBI:161001) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S)-1-(carboxymethylamino)-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-4-oxobutanoic acid