CHEBI:164461 - Trp-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 Trp-Arg-Phe
ChEBI ID CHEBI:164461
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H33N7O4
Net Charge 0
Average Mass 507.595
Monoisotopic Mass 507.25940
InChI InChI=1S/C26H33N7O4/c27-19(14-17-15-31-20-10-5-4-9-18(17)20)23(34)32-21(11-6-12-30-26(28)29)24(35)33-22(25(36)37)13-16-7-2-1-3-8-16/h1-5,7-10,15,19,21-22,31H,6,11-14,27H2,(H,32,34)(H,33,35)(H,36,37)(H4,28,29,30)/t19-,21-,22-/m0/s1
InChIKey AOAMKFFPFOPMLX-BVSLBCMMSA-N
SMILES O=C(N[C@@H](CC1=CC=CC=C1)C(O)=O)[C@@H](NC(=O)[C@@H](N)CC=2C=3C(NC2)=CC=CC3)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 Trp-Arg-Phe (CHEBI:164461) is a oligopeptide (CHEBI:25676)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-phenylpropanoic acid
Manual Xref Database
9493109 ChemSpider
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