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CHEBI:173480 - Methylthio 2-(propanoyloxy)propanoate

ChEBI IDCHEBI:173480
ChEBI NameMethylthio 2-(propanoyloxy)propanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H12O3S
Net Charge0
Average Mass176.237
Monoisotopic Mass176.05072
SMILESCCC(=O)OC(C)C(=O)SC
InChIInChI=1S/C7H12O3S/c1-4-6(8)10-5(2)7(9)11-3/h5H,4H2,1-3H3
InChIKeyVCLWCQBHEOFVMO-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Methylthio 2-(propanoyloxy)propanoate (CHEBI:173480) is a thiocarboxylic ester (CHEBI:26959)
IUPAC Name 
(1-methylsulanyl-1-oxopropan-2-yl) propanoate
Manual XrefsDatabases
20127044ChemSpider
HMDB0040003HMDB
Registry NumbersSources
CAS:827024-53-3ChemIDplus