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CHEBI:160479 - Asp-Gln-Asn

ChEBI IDCHEBI:160479
ChEBI NameAsp-Gln-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H21N5O8
Net Charge0
Average Mass375.338
Monoisotopic Mass375.13901
SMILESNC(=O)CC[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O
InChIInChI=1S/C13H21N5O8/c14-5(3-10(21)22)11(23)17-6(1-2-8(15)19)12(24)18-7(13(25)26)4-9(16)20/h5-7H,1-4,14H2,(H2,15,19)(H2,16,20)(H,17,23)(H,18,24)(H,21,22)(H,25,26)/t5-,6-,7-/m0/s1
InChIKeyWLKVEEODTPQPLI-ACZMJKKPSA-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-Gln-Asn (CHEBI:160479) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S)-5-amino-1-[[(1S)-3-amino-1-carboxy-3-oxopropyl]amino]-1,5-dioxopentan-2-yl]amino]-4-oxobutanoic acid