CHEBI:160931 - Asp-Thr-Met

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ChEBI Name Asp-Thr-Met
ChEBI ID CHEBI:160931
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H23N3O7S
Net Charge 0
Average Mass 365.400
Monoisotopic Mass 365.12567
InChI InChI=1S/C13H23N3O7S/c1-6(17)10(16-11(20)7(14)5-9(18)19)12(21)15-8(13(22)23)3-4-24-2/h6-8,10,17H,3-5,14H2,1-2H3,(H,15,21)(H,16,20)(H,18,19)(H,22,23)/t6-,7+,8+,10+/m1/s1
InChIKey UEFODXNXUAVPTC-VEVYYDQMSA-N
SMILES S(CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(O)=O)[C@H](O)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 Asp-Thr-Met (CHEBI:160931) is a peptide (CHEBI:16670)
IUPAC Name
(3S)-3-amino-4-[[(2S,3R)-1-[[(1S)-1-carboxy-3-methylsulanylpropyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-4-oxobutanoic acid