CHEBI:162716 - Glu-Arg-Phe

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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 Glu-Arg-Phe
ChEBI ID CHEBI:162716
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H30N6O6
Net Charge 0
Average Mass 450.496
Monoisotopic Mass 450.22268
InChI InChI=1S/C20H30N6O6/c21-13(8-9-16(27)28)17(29)25-14(7-4-10-24-20(22)23)18(30)26-15(19(31)32)11-12-5-2-1-3-6-12/h1-3,5-6,13-15H,4,7-11,21H2,(H,25,29)(H,26,30)(H,27,28)(H,31,32)(H4,22,23,24)/t13-,14-,15-/m0/s1
InChIKey LTUVYLVIZHJCOQ-KKUMJFAQSA-N
SMILES O=C(N[C@@H](CC1=CC=CC=C1)C(O)=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)CCCN=C(N)N
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing Glu-Arg-Phe (CHEBI:162716) is a peptide (CHEBI:16670)
IUPAC Name
(4S)-4-amino-5-[[(2S)-1-[[(1S)-1-carboxy-2-phenylethyl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-oxopentanoic acid