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CHEBI:158237 - Ala-His-Trp

ChEBI IDCHEBI:158237
ChEBI NameAla-His-Trp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24N6O4
Net Charge0
Average Mass412.450
Monoisotopic Mass412.18590
SMILESC[C@H](N)C(=O)N[C@@H](Cc1cncn1)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C20H24N6O4/c1-11(21)18(27)25-16(7-13-9-22-10-24-13)19(28)26-17(20(29)30)6-12-8-23-15-5-3-2-4-14(12)15/h2-5,8-11,16-17,23H,6-7,21H2,1H3,(H,22,24)(H,25,27)(H,26,28)(H,29,30)/t11-,16-,17-/m0/s1
InChIKeyGRIFPSOFWFIICX-GOPGUHFVSA-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)
Ala-His-Trp (CHEBI:158237) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoic acid