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CHEBI:166410 - Val-Trp-Trp

ChEBI IDCHEBI:166410
ChEBI NameVal-Trp-Trp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H31N5O4
Net Charge0
Average Mass489.576
Monoisotopic Mass489.23760
SMILESCC(C)[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C27H31N5O4/c1-15(2)24(28)26(34)31-22(11-16-13-29-20-9-5-3-7-18(16)20)25(33)32-23(27(35)36)12-17-14-30-21-10-6-4-8-19(17)21/h3-10,13-15,22-24,29-30H,11-12,28H2,1-2H3,(H,31,34)(H,32,33)(H,35,36)/t22-,23-,24-/m0/s1
InChIKeyHOZAIQIEJTWWDG-HJOGWXRNSA-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)
Val-Trp-Trp (CHEBI:166410) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoic acid