CHEBI:159039 - Arg-Ile-Ala

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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-Ile-Ala
ChEBI ID CHEBI:159039
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H30N6O4
Net Charge 0
Average Mass 358.443
Monoisotopic Mass 358.23285
InChI InChI=1S/C15H30N6O4/c1-4-8(2)11(13(23)20-9(3)14(24)25)21-12(22)10(16)6-5-7-19-15(17)18/h8-11H,4-7,16H2,1-3H3,(H,20,23)(H,21,22)(H,24,25)(H4,17,18,19)/t8-,9-,10-,11-/m0/s1
InChIKey UBCPNBUIQNMDNH-NAKRPEOUSA-N
SMILES O=C(N[C@@H](C)C(O)=O)[C@@H](NC(=O)[C@@H](N)CCCN=C(N)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 )
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ChEBI Ontology
Outgoing Arg-Ile-Ala (CHEBI:159039) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S,3S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylpentanoyl]amino]propanoic acid