EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:163502 - Gly-Asn-Ile

ChEBI IDCHEBI:163502
ChEBI NameGly-Asn-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22N4O5
Net Charge0
Average Mass302.331
Monoisotopic Mass302.15902
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)CN)C(=O)O
InChIInChI=1S/C12H22N4O5/c1-3-6(2)10(12(20)21)16-11(19)7(4-8(14)17)15-9(18)5-13/h6-7,10H,3-5,13H2,1-2H3,(H2,14,17)(H,15,18)(H,16,19)(H,20,21)/t6-,7-,10-/m0/s1
InChIKeyBGVYNAQWHSTTSP-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)
Gly-Asn-Ile (CHEBI:163502) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-4-amino-2-[(2-aminoacetyl)amino]-4-oxobutanoyl]amino]-3-methylpentanoic acid