CHEBI:166092 - Val-Arg-Tyr

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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 Val-Arg-Tyr
ChEBI ID CHEBI:166092
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H32N6O5
Net Charge 0
Average Mass 436.513
Monoisotopic Mass 436.24342
InChI InChI=1S/C20H32N6O5/c1-11(2)16(21)18(29)25-14(4-3-9-24-20(22)23)17(28)26-15(19(30)31)10-12-5-7-13(27)8-6-12/h5-8,11,14-16,27H,3-4,9-10,21H2,1-2H3,(H,25,29)(H,26,28)(H,30,31)(H4,22,23,24)/t14-,15-,16-/m0/s1
InChIKey WKWJJQZZZBBWKV-JYJNAYRXSA-N
SMILES O=C(N[C@@H](CC1=CC=C(O)C=C1)C(O)=O)[C@@H](NC(=O)[C@@H](N)C(C)C)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 Val-Arg-Tyr (CHEBI:166092) is a oligopeptide (CHEBI:25676)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
Manual Xref Database
7978833 ChemSpider
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