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CHEBI:159360 - Arg-Trp-Arg

Default Structure
ChEBI IDCHEBI:159360
ChEBI NameArg-Trp-Arg
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H36N10O4
Net Charge0
Average Mass516.607
Monoisotopic Mass516.29210
SMILESNC(N)=NCCC[C@H](NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)O
InChIInChI=1S/C23H36N10O4/c24-15(6-3-9-29-22(25)26)19(34)33-18(11-13-12-31-16-7-2-1-5-14(13)16)20(35)32-17(21(36)37)8-4-10-30-23(27)28/h1-2,5,7,12,15,17-18,31H,3-4,6,8-11,24H2,(H,32,35)(H,33,34)(H,36,37)(H4,25,26,29)(H4,27,28,30)/t15-,17-,18-/m0/s1
InChIKeyQUBKBPZGMZWOKQ-SZMVWBNQSA-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)
Arg-Trp-Arg (CHEBI:159360) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
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