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CHEBI:164272 - His-Asn-Asn

ChEBI IDCHEBI:164272
ChEBI NameHis-Asn-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H21N7O6
Net Charge0
Average Mass383.365
Monoisotopic Mass383.15533
SMILESNC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1cncn1)C(=O)O
InChIInChI=1S/C14H21N7O6/c15-7(1-6-4-18-5-19-6)12(24)20-8(2-10(16)22)13(25)21-9(14(26)27)3-11(17)23/h4-5,7-9H,1-3,15H2,(H2,16,22)(H2,17,23)(H,18,19)(H,20,24)(H,21,25)(H,26,27)/t7-,8-,9-/m0/s1
InChIKeyAVQOSMRPITVTRB-CIUDSAMLSA-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)
His-Asn-Asn (CHEBI:164272) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[(2S)-4-amino-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-4-oxobutanoyl]amino]-4-oxobutanoic acid