CHEBI:158891 - Ile-Val-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 Ile-Val-Arg
ChEBI ID CHEBI:158891
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H34N6O4
Net Charge 0
Average Mass 386.497
Monoisotopic Mass 386.26415
InChI InChI=1S/C17H34N6O4/c1-5-10(4)12(18)14(24)23-13(9(2)3)15(25)22-11(16(26)27)7-6-8-21-17(19)20/h9-13H,5-8,18H2,1-4H3,(H,22,25)(H,23,24)(H,26,27)(H4,19,20,21)/t10-,11-,12-,13-/m0/s1
InChIKey IPFKIGNDTUOFAF-CYDGBPFRSA-N
SMILES O=C(N[C@@H](C(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O)[C@@H](N)[C@H](CC)C
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Ile-Val-Arg (CHEBI:158891) is a oligopeptide (CHEBI:25676)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylbutanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Manual Xref Database
16572253 ChemSpider
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