CHEBI:161674 - Phe-Lys-Arg

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Phe-Lys-Arg
ChEBI ID CHEBI:161674
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H35N7O4
Net Charge 0
Average Mass 449.556
Monoisotopic Mass 449.27505
InChI InChI=1S/C21H35N7O4/c22-11-5-4-9-16(27-18(29)15(23)13-14-7-2-1-3-8-14)19(30)28-17(20(31)32)10-6-12-26-21(24)25/h1-3,7-8,15-17H,4-6,9-13,22-23H2,(H,27,29)(H,28,30)(H,31,32)(H4,24,25,26)/t15-,16-,17-/m0/s1
InChIKey DMEYUTSDVRCWRS-ULQDDVLXSA-N
SMILES O=C(N[C@@H](CCCN=C(N)N)C(O)=O)[C@@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)CCCCN
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Phe-Lys-Arg (CHEBI:161674) is a oligopeptide (CHEBI:25676)
IUPAC Name
(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]hexanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Manual Xref Database
16573619 ChemSpider
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