CHEBI:164088 - Thr-Met-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 Thr-Met-Ala
ChEBI ID CHEBI:164088
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H23N3O5S
Net Charge 0
Average Mass 321.390
Monoisotopic Mass 321.13584
InChI InChI=1S/C12H23N3O5S/c1-6(12(19)20)14-10(17)8(4-5-21-3)15-11(18)9(13)7(2)16/h6-9,16H,4-5,13H2,1-3H3,(H,14,17)(H,15,18)(H,19,20)/t6-,7+,8-,9-/m0/s1
InChIKey UJQVSMNQMQHVRY-KZVJFYERSA-N
SMILES S(CC[C@H](NC(=O)[C@@H](N)[C@H](O)C)C(=O)N[C@@H](C)C(O)=O)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 Thr-Met-Ala (CHEBI:164088) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-4-methylsulanylbutanoyl]amino]propanoic acid