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CHEBI:158414 - Ile-Gly-Asn

ChEBI IDCHEBI:158414
ChEBI NameIle-Gly-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22N4O5
Net Charge0
Average Mass302.331
Monoisotopic Mass302.15902
SMILESCC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O
InChIInChI=1S/C12H22N4O5/c1-3-6(2)10(14)11(19)15-5-9(18)16-7(12(20)21)4-8(13)17/h6-7,10H,3-5,14H2,1-2H3,(H2,13,17)(H,15,19)(H,16,18)(H,20,21)/t6-,7-,10-/m0/s1
InChIKeySLQVFYWBGNNOTK-BYULHYEWSA-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-Gly-Asn (CHEBI:158414) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]acetyl]amino]-4-oxobutanoic acid