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CHEBI:159069 - Leu-Asp-Trp

ChEBI IDCHEBI:159069
ChEBI NameLeu-Asp-Trp
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Last Modified20 March 2025
SubmitterMetaboLights
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FormulaC21H28N4O6
Net Charge0
Average Mass432.477
Monoisotopic Mass432.20088
SMILESCC(C)C[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C21H28N4O6/c1-11(2)7-14(22)19(28)24-16(9-18(26)27)20(29)25-17(21(30)31)8-12-10-23-15-6-4-3-5-13(12)15/h3-6,10-11,14,16-17,23H,7-9,22H2,1-2H3,(H,24,28)(H,25,29)(H,26,27)(H,30,31)/t14-,16-,17-/m0/s1
InChIKeyGBDMISNMNXVTNV-XIRDDKMYSA-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)
Leu-Asp-Trp (CHEBI:159069) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-[[(2S)-2-amino-4-methylpentanoyl]amino]-4-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-4-oxobutanoic acid