Chem
J-GLOBAL ID:200907090111507243   Nikkaji number:J1.067.905B

(2S,3R)-2-Hydroxy-2-methyl-3-isobutyl-4-oxo-4-(tert-butylthio)butanoic acid methyl ester

(2S,3R)-2-ヒドロキシ-2-メチル-3-イソブチル-4-オキソ-4-(tert-ブチルチオ)ブタン酸メチル
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: C14H26O4S
Molecular formula furigana: C14-H26-O4-S
Molecular weight: 290.420
InChI: InChI=1S/C14H26O4S/c1-9(2)8-10(11(15)19-13(3,4)5)14(6,17)12(16)18-7/h9-10,17H,8H2,1-7H3/t10-,14-/m0/s1
InChI key: DHXXBFXCKRKLLY-HZMBPMFUSA-N
SMILES: COC(=O)[C@@](C)(O)[C@@H](CC(C)C)C(=O)SC(C)(C)C
Systematic name  (3):
  • (2S,3R)-2-ヒドロキシ-2-メチル-3-イソブチル-4-オキソ-4-(tert-ブチルチオ)ブタン酸メチル
  • メチル (2S,3R)-3-[(tert-ブチルスルファニル)カルボニル]-2-ヒドロキシ-2,5-ジメチルヘキサノアート
  • methyl (2S,3R)-3-[(tert-butylsulfanyl)carbonyl]-2-hydroxy-2,5-dimethylhexanoate
Other name (1):
  • (2S,3R)-2-Hydroxy-2-methyl-3-isobutyl-4-oxo-4-(tert-butylthio)butanoic acid methyl ester
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