CHEBI:158795 - Arg-Asn-Trp

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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 Arg-Asn-Trp
ChEBI ID CHEBI:158795
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H30N8O5
Net Charge 0
Average Mass 474.522
Monoisotopic Mass 474.23392
InChI InChI=1S/C21H30N8O5/c22-13(5-3-7-26-21(24)25)18(31)28-15(9-17(23)30)19(32)29-16(20(33)34)8-11-10-27-14-6-2-1-4-12(11)14/h1-2,4,6,10,13,15-16,27H,3,5,7-9,22H2,(H2,23,30)(H,28,31)(H,29,32)(H,33,34)(H4,24,25,26)/t13-,15-,16-/m0/s1
InChIKey OCOZPTHLDVSFCZ-BPUTZDHNSA-N
SMILES O=C(N[C@@H](CC=1C=2C(NC1)=CC=CC2)C(O)=O)[C@@H](NC(=O)[C@@H](N)CCCN=C(N)N)CC(=O)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 Arg-Asn-Trp (CHEBI:158795) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-4-oxobutanoyl]amino]-3-(1H-indol-3-yl)propanoic acid