Chem
J-GLOBAL ID：200907036981658455   Nikkaji number：J711.473G

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

(3R,4R)-ジヒドロ-3-(2-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： C21H21ClO7
Molecular formula furigana： C21-H21-CL-O7
Molecular weight： 420.840
InChI： InChI=1S/C21H21ClO7/c1-25-17-8-12(18(22)20(26-2)19(17)23)7-14-13(9-27-21(14)24)5-11-3-4-15-16(6-11)29-10-28-15/h3-4,6,8,13-14,23H,5,7,9-10H2,1-2H3/t13-,14+/m0/s1
InChI key： FVORVXQVTFSNEN-UONOGXRCSA-N
SMILES： COc1cc(C[C@@H]2[C@@H](Cc3ccc4OCOc4c3)COC2=O)c(Cl)c(OC)c1O
Systematic name  (3)：
  • (3R,4R)-ジヒドロ-3-(2-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
  • (3R,4R)-4-[(2H-1,3-ベンゾジオキソール-5-イル)メチル]-3-[(2-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
  • (3R,4R)-4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(2-chloro-4-hydroxy-3,5-dimethoxyphenyl)methyl]oxolan-2-one
Other name (1)：
  • (3R,4R)-Dihydro-3-(2-chloro-3,5-dimethoxy-4-hydroxybenzyl)-4-[(1,3-benzodioxol-5-yl)methyl]furan-2(3H)-one
Thsaurus map：
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