CHEBI:161945 - Phe-Tyr-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-Tyr-Arg
ChEBI ID CHEBI:161945
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H32N6O5
Net Charge 0
Average Mass 484.557
Monoisotopic Mass 484.24342
InChI InChI=1S/C24H32N6O5/c25-18(13-15-5-2-1-3-6-15)21(32)30-20(14-16-8-10-17(31)11-9-16)22(33)29-19(23(34)35)7-4-12-28-24(26)27/h1-3,5-6,8-11,18-20,31H,4,7,12-14,25H2,(H,29,33)(H,30,32)(H,34,35)(H4,26,27,28)/t18-,19-,20-/m0/s1
InChIKey VFDRDMOMHBJGKD-UFYCRDLUSA-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)CC2=CC=C(O)C=C2
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 Phe-Tyr-Arg (CHEBI:161945) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Manual Xref Database
16573750 ChemSpider
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