Chem
J-GLOBAL ID：200907007207007980   Nikkaji number：J711.480J

(3S,4S)-Dihydro-3-(2-chloro-3,4,5-trimethoxybenzyl)-4-[(1,3-benzodioxol-5-yl)methyl]furan-2(3H)-one

(3S,4S)-ジヒドロ-3-(2-クロロ-3,4,5-トリメトキシベンジル)-4-[(1,3-ベンゾジオキソール-5-イル)メチル]フラン-2(3H)-オン
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： C22H23ClO7
Molecular formula furigana： C22-H23-CL-O7
Molecular weight： 434.870
InChI： InChI=1S/C22H23ClO7/c1-25-18-9-13(19(23)21(27-3)20(18)26-2)8-15-14(10-28-22(15)24)6-12-4-5-16-17(7-12)30-11-29-16/h4-5,7,9,14-15H,6,8,10-11H2,1-3H3/t14-,15+/m1/s1
InChI key： SQUAFWGBYGVHDV-CABCVRRESA-N
SMILES： COc1cc(C[C@H]2[C@H](Cc3ccc4OCOc4c3)COC2=O)c(Cl)c(OC)c1OC
Systematic name  (3)：
  • (3S,4S)-ジヒドロ-3-(2-クロロ-3,4,5-トリメトキシベンジル)-4-[(1,3-ベンゾジオキソール-5-イル)メチル]フラン-2(3H)-オン
  • (3S,4S)-4-[(2H-1,3-ベンゾジオキソール-5-イル)メチル]-3-[(2-クロロ-3,4,5-トリメトキシフェニル)メチル]オキソラン-2-オン
  • (3S,4S)-4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(2-chloro-3,4,5-trimethoxyphenyl)methyl]oxolan-2-one
Other name (1)：
  • (3S,4S)-Dihydro-3-(2-chloro-3,4,5-trimethoxybenzyl)-4-[(1,3-benzodioxol-5-yl)methyl]furan-2(3H)-one
Thsaurus map：
Thesaurus Map

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