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CHEBI:158019 - Ala-Asn-Val

ChEBI IDCHEBI:158019
ChEBI NameAla-Asn-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22N4O5
Net Charge0
Average Mass302.331
Monoisotopic Mass302.15902
SMILESCC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)N)C(=O)O
InChIInChI=1S/C12H22N4O5/c1-5(2)9(12(20)21)16-11(19)7(4-8(14)17)15-10(18)6(3)13/h5-7,9H,4,13H2,1-3H3,(H2,14,17)(H,15,18)(H,16,19)(H,20,21)/t6-,7-,9-/m0/s1
InChIKeyZIBWKCRKNFYTPT-ZKWXMUAHSA-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)
Ala-Asn-Val (CHEBI:158019) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-aminopropanoyl]amino]-4-oxobutanoyl]amino]-3-methylbutanoic acid