7-(methylsulfanyl)-2-oxoheptanoate

7-(methylsulfanyl)-2-oxoheptanoate




Chemical Formula:
C8H13O3S
Molecular Weight:
189.249 Daltons
Monoisotopic Mass:
190.06636500570002 Daltons
SMILES:
CSCCCCCC(=O)C([O-])=O
InChI:
1S/C8H14O3S/c1-12-6-4-2-3-5-7(9)8(10)11/h2-6H2,1H3,(H,10,11)/p-1
InChIKey:
TWAIOPPFLZEXCO-UHFFFAOYSA-M

Synonyms
  • 7-(methylthio)-2-oxoheptanoic acid
  • 7-(methylthio)-2-oxoheptanoate

Databases
MetaCyc:  CPDQT-28
PubChem (CID):  44237184
KNApSAcK:  C00007645
Seed:  cpd17410
ChEBI:  80968
MetaNetX:  MNXM3820
KEGG:  C17220