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CHEBI:160583 - Asp-Gly-Trp

ChEBI IDCHEBI:160583
ChEBI NameAsp-Gly-Trp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H20N4O6
Net Charge0
Average Mass376.369
Monoisotopic Mass376.13828
SMILESN[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C17H20N4O6/c18-11(6-15(23)24)16(25)20-8-14(22)21-13(17(26)27)5-9-7-19-12-4-2-1-3-10(9)12/h1-4,7,11,13,19H,5-6,8,18H2,(H,20,25)(H,21,22)(H,23,24)(H,26,27)/t11-,13-/m0/s1
InChIKeyNRIFEOUAFLTMFJ-AAEUAGOBSA-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)
Asp-Gly-Trp (CHEBI:160583) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[2-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]amino]-4-oxobutanoic acid