Chem
J-GLOBAL ID：200907019248793972   Nikkaji number：J1.712.577J

(3R)-3-Hydroxy-5-phenyl-4-pentenethioic acid S-ethyl ester

(3R)-3-ヒドロキシ-5-フェニル-4-ペンテンチオ酸S-エチル
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： C13H16O2S
Molecular formula furigana： C13-H16-O2-S
Molecular weight： 236.330
InChI： InChI=1S/C13H16O2S/c1-2-16-13(15)10-12(14)9-8-11-6-4-3-5-7-11/h3-9,12,14H,2,10H2,1H3/t12-/m0/s1
InChI key： BAQYZRHXYWVJMD-LBPRGKRZSA-N
SMILES： CCSC(=O)C[C@@H](O)C=Cc1ccccc1
Systematic name  (3)：
  • (3R)-3-ヒドロキシ-5-フェニル-4-ペンテンチオ酸S-エチル
  • (3R)-1-(エチルスルファニル)-3-ヒドロキシ-5-フェニルペンタ-4-エン-1-オン
  • (3R)-1-(ethylsulfanyl)-3-hydroxy-5-phenylpent-4-en-1-one
Other name (1)：
  • (3R)-3-Hydroxy-5-phenyl-4-pentenethioic acid S-ethyl ester
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