CHEBI:158673 - Ala-Val-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-Val-Thr
ChEBI ID CHEBI:158673
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H23N3O5
Net Charge 0
Average Mass 289.332
Monoisotopic Mass 289.16377
InChI InChI=1S/C12H23N3O5/c1-5(2)8(14-10(17)6(3)13)11(18)15-9(7(4)16)12(19)20/h5-9,16H,13H2,1-4H3,(H,14,17)(H,15,18)(H,19,20)/t6-,7+,8-,9-/m0/s1
InChIKey OMSKGWFGWCQFBD-KZVJFYERSA-N
SMILES O=C(N[C@@H]([C@H](O)C)C(O)=O)[C@@H](NC(=O)[C@@H](N)C)C(C)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-Val-Thr (CHEBI:158673) is a peptide (CHEBI:16670)
IUPAC Name
(2S,3R)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxybutanoic acid