CHEBI:158355 - Ala-Lys-Thr

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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-Lys-Thr
ChEBI ID CHEBI:158355
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H26N4O5
Net Charge 0
Average Mass 318.374
Monoisotopic Mass 318.19032
InChI InChI=1S/C13H26N4O5/c1-7(15)11(19)16-9(5-3-4-6-14)12(20)17-10(8(2)18)13(21)22/h7-10,18H,3-6,14-15H2,1-2H3,(H,16,19)(H,17,20)(H,21,22)/t7-,8+,9-,10-/m0/s1
InChIKey OINVDEKBKBCPLX-JXUBOQSCSA-N
SMILES O=C(N[C@@H]([C@H](O)C)C(O)=O)[C@@H](NC(=O)[C@@H](N)C)CCCCN
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-Lys-Thr (CHEBI:158355) is a peptide (CHEBI:16670)
IUPAC Name
(2S,3R)-2-[[(2S)-6-amino-2-[[(2S)-2-aminopropanoyl]amino]hexanoyl]amino]-3-hydroxybutanoic acid