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CHEBI:164438 - Trp-Arg-Asn

ChEBI IDCHEBI:164438
ChEBI NameTrp-Arg-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H30N8O5
Net Charge0
Average Mass474.522
Monoisotopic Mass474.23392
SMILESNC(=O)C[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C21H30N8O5/c22-13(8-11-10-27-14-5-2-1-4-12(11)14)18(31)28-15(6-3-7-26-21(24)25)19(32)29-16(20(33)34)9-17(23)30/h1-2,4-5,10,13,15-16,27H,3,6-9,22H2,(H2,23,30)(H,28,31)(H,29,32)(H,33,34)(H4,24,25,26)/t13-,15-,16-/m0/s1
InChIKeyPNKDNKGMEHJTJQ-BPUTZDHNSA-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)
Trp-Arg-Asn (CHEBI:164438) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-oxobutanoic acid