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CHEBI:161714 - Phe-Met-Arg

ChEBI IDCHEBI:161714
ChEBI NamePhe-Met-Arg
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32N6O4S
Net Charge0
Average Mass452.581
Monoisotopic Mass452.22057
SMILESCSCC[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O
InChIInChI=1S/C20H32N6O4S/c1-31-11-9-15(25-17(27)14(21)12-13-6-3-2-4-7-13)18(28)26-16(19(29)30)8-5-10-24-20(22)23/h2-4,6-7,14-16H,5,8-12,21H2,1H3,(H,25,27)(H,26,28)(H,29,30)(H4,22,23,24)/t14-,15-,16-/m0/s1
InChIKeyIEOHQGFKHXUALJ-JYJNAYRXSA-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)
Phe-Met-Arg (CHEBI:161714) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-4-methylsulanylbutanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Manual XrefsDatabases
16573636ChemSpider