Chem
J-GLOBAL ID：200907027326938691   Nikkaji number：J711.476A

(3S,4S)-Dihydro-3-(2,6-dichloro-3,5-dimethoxy-4-hydroxybenzyl)-4-[(1,3-benzodioxol-5-yl)methyl]furan-2(3H)-one

(3S,4S)-ジヒドロ-3-(2,6-ジクロロ-3,5-ジメトキシ-4-ヒドロキシベンジル)-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： C21H20Cl2O7
Molecular formula furigana： C21-H20-CL2-O7
Molecular weight： 455.280
InChI： InChI=1S/C21H20Cl2O7/c1-26-19-16(22)13(17(23)20(27-2)18(19)24)7-12-11(8-28-21(12)25)5-10-3-4-14-15(6-10)30-9-29-14/h3-4,6,11-12,24H,5,7-9H2,1-2H3/t11-,12+/m1/s1
InChI key： HBZPXIHJRZLWRR-NEPJUHHUSA-N
SMILES： COc1c(O)c(OC)c(Cl)c(C[C@H]2[C@H](Cc3ccc4OCOc4c3)COC2=O)c1Cl
Systematic name  (3)：
  • (3S,4S)-ジヒドロ-3-(2,6-ジクロロ-3,5-ジメトキシ-4-ヒドロキシベンジル)-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-[(2,6-ジクロロ-4-ヒドロキシ-3,5-ジメトキシフェニル)メチル]オキソラン-2-オン
  • (3S,4S)-4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(2,6-dichloro-4-hydroxy-3,5-dimethoxyphenyl)methyl]oxolan-2-one
Other name (1)：
  • (3S,4S)-Dihydro-3-(2,6-dichloro-3,5-dimethoxy-4-hydroxybenzyl)-4-[(1,3-benzodioxol-5-yl)methyl]furan-2(3H)-one
Thsaurus map：
Thesaurus Map

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