CHEBI:173329 - Methyl 2-(methylthio)acetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Methyl 2-(methylthio)acetate
ChEBI ID CHEBI:173329
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C4H8O2S
Net Charge 0
Average Mass 120.170
Monoisotopic Mass 120.02450
InChI InChI=1S/C4H8O2S/c1-6-4(5)3-7-2/h3H2,1-2H3
InChIKey HZYCAKGEXXKCDM-UHFFFAOYSA-N
SMILES S(CC(OC)=O)C
ChEBI Ontology
Outgoing Methyl 2-(methylthio)acetate (CHEBI:173329) is a carboxylic ester (CHEBI:33308)
IUPAC Name
methyl 2-methylsulanylacetate
Manual Xrefs Databases
77131 ChemSpider
C03173 KEGG COMPOUND
HMDB0035646 HMDB
S-METHYLTHIOGLYCOLATE MetaCyc
View more database links
Registry Number Type Source
16630-66-3 CAS Registry Number ChemIDplus