Chem
J-GLOBAL ID:200907006256467427   Nikkaji number:J535.544C

(2R)-2α-Phenethyl-3-(4-ethoxy-4-oxobutyl)-4-methylene-5-oxotetrahydrofuran-3β-carboxylic acid ethyl ester

(2R)-2α-フェネチル-3-(4-エトキシ-4-オキソブチル)-4-メチレン-5-オキソテトラヒドロフラン-3β-カルボン酸エチル
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: C22H28O6
Molecular formula furigana: C22-H28-O6
Molecular weight: 388.460
InChI: InChI=1S/C22H28O6/c1-4-26-19(23)12-9-15-22(21(25)27-5-2)16(3)20(24)28-18(22)14-13-17-10-7-6-8-11-17/h6-8,10-11,18H,3-5,9,12-15H2,1-2H3/t18-,22+/m1/s1
InChI key: GGSUVRWOVOGOFV-GCJKJVERSA-N
SMILES: CCOC(=O)CCC[C@]1([C@@H](CCc2ccccc2)OC(=O)C1=C)C(=O)OCC
Systematic name  (3):
  • (2R)-2α-フェネチル-3-(4-エトキシ-4-オキソブチル)-4-メチレン-5-オキソテトラヒドロフラン-3β-カルボン酸エチル
  • エチル (2R,3S)-3-(4-エトキシ-4-オキソブチル)-4-メチリデン-5-オキソ-2-(2-フェニルエチル)オキソラン-3-カルボキシラート
  • ethyl (2R,3S)-3-(4-ethoxy-4-oxobutyl)-4-methylidene-5-oxo-2-(2-phenylethyl)oxolane-3-carboxylate
Other name (1):
  • (2R)-2α-Phenethyl-3-(4-ethoxy-4-oxobutyl)-4-methylene-5-oxotetrahydrofuran-3β-carboxylic acid ethyl ester
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