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CHEBI:160046 - Asn-Pro-Gln

Default Structure
ChEBI IDCHEBI:160046
ChEBI NameAsn-Pro-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H23N5O6
Net Charge0
Average Mass357.367
Monoisotopic Mass357.16483
SMILESNC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(N)=O)C(=O)O
InChIInChI=1S/C14H23N5O6/c15-7(6-11(17)21)13(23)19-5-1-2-9(19)12(22)18-8(14(24)25)3-4-10(16)20/h7-9H,1-6,15H2,(H2,16,20)(H2,17,21)(H,18,22)(H,24,25)/t7-,8-,9-/m0/s1
InChIKeyXMHFCUKJRCQXGI-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)
Asn-Pro-Gln (CHEBI:160046) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-1-[(2S)-2,4-diamino-4-oxobutanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoic acid