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CHEBI:160991 - Asp-Tyr-Asn

ChEBI IDCHEBI:160991
ChEBI NameAsp-Tyr-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H22N4O8
Net Charge0
Average Mass410.383
Monoisotopic Mass410.14376
SMILESNC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)O
InChIInChI=1S/C17H22N4O8/c18-10(6-14(24)25)15(26)20-11(5-8-1-3-9(22)4-2-8)16(27)21-12(17(28)29)7-13(19)23/h1-4,10-12,22H,5-7,18H2,(H2,19,23)(H,20,26)(H,21,27)(H,24,25)(H,28,29)/t10-,11-,12-/m0/s1
InChIKeyNJLLRXWFPQQPHV-SRVKXCTJSA-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-Asn (CHEBI:160991) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S)-1-[[(1S)-3-amino-1-carboxy-3-oxopropyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-4-oxobutanoic acid