Chem
J-GLOBAL ID：201007095273873483   Nikkaji number：J2.806.002E

2-Oxo-7-methylthioheptanoic acid

7-(メチルチオ)-2-オキソヘプタン酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C8H14O3S
Molecular formula furigana： C8-H14-O3-S
Molecular weight： 190.260
InChI： InChI=1S/C8H14O3S/c1-12-6-4-2-3-5-7(9)8(10)11/h2-6H2,1H3,(H,10,11)
InChI key： TWAIOPPFLZEXCO-UHFFFAOYSA-N
SMILES： CSCCCCCC(=O)C(=O)O
Systematic name  (3)：
  • 7-(メチルチオ)-2-オキソヘプタン酸
  • 7-(メチルスルファニル)-2-オキソヘプタン酸
  • 7-(methylsulfanyl)-2-oxoheptanoic acid
Other name (3)：
  • 7-(Methylthio)-2-oxoheptanoic acid
  • 2-Oxo-7-methylthioheptanoic acid
  • 7-(Methylthio)-2-oxo-heptanoic acid
KEGG COMPOUND： C17220
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