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CHEBI:160248 - Asn-Val-Gln

Default Structure
ChEBI IDCHEBI:160248
ChEBI NameAsn-Val-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H25N5O6
Net Charge0
Average Mass359.383
Monoisotopic Mass359.18048
SMILESCC(C)[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C14H25N5O6/c1-6(2)11(19-12(22)7(15)5-10(17)21)13(23)18-8(14(24)25)3-4-9(16)20/h6-8,11H,3-5,15H2,1-2H3,(H2,16,20)(H2,17,21)(H,18,23)(H,19,22)(H,24,25)/t7-,8-,11-/m0/s1
InChIKeyLTDGPJKGJDIBQD-LAEOZQHASA-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-Val-Gln (CHEBI:160248) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-3-methylbutanoyl]amino]-5-oxopentanoic acid