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CHEBI:158747 - Arg-Arg-Phe

ChEBI IDCHEBI:158747
ChEBI NameArg-Arg-Phe
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H35N9O4
Net Charge0
Average Mass477.570
Monoisotopic Mass477.28120
SMILESNC(N)=NCCC[C@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C21H35N9O4/c22-14(8-4-10-27-20(23)24)17(31)29-15(9-5-11-28-21(25)26)18(32)30-16(19(33)34)12-13-6-2-1-3-7-13/h1-3,6-7,14-16H,4-5,8-12,22H2,(H,29,31)(H,30,32)(H,33,34)(H4,23,24,27)(H4,25,26,28)/t14-,15-,16-/m0/s1
InChIKeyPVSNBTCXCQIXSE-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)
Arg-Arg-Phe (CHEBI:158747) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-phenylpropanoic acid
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