Chem
J-GLOBAL ID：200907076673702194   Nikkaji number：J1.952.472H

(1β,4β,8S)-5-Oxo-6,6-dimethoxy-8-(benzoyloxy)bicyclo[2.2.2]octa-2-ene-2-carboxylic acid methyl ester

(1β,4β,8S)-5-オキソ-6,6-ジメトキシ-8-(ベンゾイルオキシ)ビシクロ[2.2.2]オクタ-2-エン-2-カルボン酸メチル
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： C19H20O7
Molecular formula furigana： C19-H20-O7
Molecular weight： 360.362
InChI： InChI=1S/C19H20O7/c1-23-18(22)12-9-13-15(26-17(21)11-7-5-4-6-8-11)10-14(12)19(24-2,25-3)16(13)20/h4-9,13-15H,10H2,1-3H3/t13-,14-,15-/m0/s1
InChI key： ADOPHLWGQMOMQY-KKUMJFAQSA-N
SMILES： COC(=O)C1=C[C@H]2[C@H](C[C@@H]1C(OC)(OC)C2=O)OC(=O)c1ccccc1
Systematic name  (3)：
  • (1β,4β,8S)-5-オキソ-6,6-ジメトキシ-8-(ベンゾイルオキシ)ビシクロ[2.2.2]オクタ-2-エン-2-カルボン酸メチル
  • メチル (1S,4S,8S)-8-(ベンゾイルオキシ)-6,6-ジメトキシ-5-オキソビシクロ[2.2.2]オクタ-2-エン-2-カルボキシラート
  • methyl (1S,4S,8S)-8-(benzoyloxy)-6,6-dimethoxy-5-oxobicyclo[2.2.2]oct-2-ene-2-carboxylate
Other name (1)：
  • (1β,4β,8S)-5-Oxo-6,6-dimethoxy-8-(benzoyloxy)bicyclo[2.2.2]octa-2-ene-2-carboxylic acid methyl ester
Thsaurus map：
Thesaurus Map

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