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CHEBI:162998 - Glu-Ile-His

ChEBI IDCHEBI:162998
ChEBI NameGlu-Ile-His
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H27N5O6
Net Charge0
Average Mass397.432
Monoisotopic Mass397.19613
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](Cc1cncn1)C(=O)O
InChIInChI=1S/C17H27N5O6/c1-3-9(2)14(22-15(25)11(18)4-5-13(23)24)16(26)21-12(17(27)28)6-10-7-19-8-20-10/h7-9,11-12,14H,3-6,18H2,1-2H3,(H,19,20)(H,21,26)(H,22,25)(H,23,24)(H,27,28)/t9-,11-,12-,14-/m0/s1
InChIKeyBKRQSECBKKCCKW-HVTMNAMFSA-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)
Glu-Ile-His (CHEBI:162998) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-amino-5-[[(2S,3S)-1-[[(1S)-1-carboxy-2-(1H-imidazol-5-yl)ethyl]amino]-3-methyl-1-oxopentan-2-yl]amino]-5-oxopentanoic acid