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CHEBI:158893 - Ile-Val-Asn

ChEBI IDCHEBI:158893
ChEBI NameIle-Val-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H28N4O5
Net Charge0
Average Mass344.412
Monoisotopic Mass344.20597
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C
InChIInChI=1S/C15H28N4O5/c1-5-8(4)11(17)13(21)19-12(7(2)3)14(22)18-9(15(23)24)6-10(16)20/h7-9,11-12H,5-6,17H2,1-4H3,(H2,16,20)(H,18,22)(H,19,21)(H,23,24)/t8-,9-,11-,12-/m0/s1
InChIKeyZYVTXBXHIKGZMD-QSFUFRPTSA-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)
Ile-Val-Asn (CHEBI:158893) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylbutanoyl]amino]-4-oxobutanoic acid