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CHEBI:164713 - Trp-Ile-Ala

ChEBI IDCHEBI:164713
ChEBI NameTrp-Ile-Ala
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H28N4O4
Net Charge0
Average Mass388.468
Monoisotopic Mass388.21106
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1cnc2ccccc12)C(=O)N[C@@H](C)C(=O)O
InChIInChI=1S/C20H28N4O4/c1-4-11(2)17(19(26)23-12(3)20(27)28)24-18(25)15(21)9-13-10-22-16-8-6-5-7-14(13)16/h5-8,10-12,15,17,22H,4,9,21H2,1-3H3,(H,23,26)(H,24,25)(H,27,28)/t11-,12-,15-,17-/m0/s1
InChIKeyYYXIWHBHTARPOG-HJXMPXNTSA-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)
Trp-Ile-Ala (CHEBI:164713) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-methylpentanoyl]amino]propanoic acid