CHEBI:158265 - Ala-Ile-Lys

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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 Ala-Ile-Lys
ChEBI ID CHEBI:158265
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H30N4O4
Net Charge 0
Average Mass 330.429
Monoisotopic Mass 330.22671
InChI InChI=1S/C15H30N4O4/c1-4-9(2)12(19-13(20)10(3)17)14(21)18-11(15(22)23)7-5-6-8-16/h9-12H,4-8,16-17H2,1-3H3,(H,18,21)(H,19,20)(H,22,23)/t9-,10-,11-,12-/m0/s1
InChIKey RZZMZYZXNJRPOJ-BJDJZHNGSA-N
SMILES O=C(N[C@@H](CCCCN)C(O)=O)[C@@H](NC(=O)[C@@H](N)C)[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 Ala-Ile-Lys (CHEBI:158265) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-aminopropanoyl]amino]-3-methylpentanoyl]amino]hexanoic acid
Manual Xref Database
16568591 ChemSpider
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