Chem
J-GLOBAL ID:200907050476781270   Nikkaji number:J1.635.095H

(α′S)-2β-(3,4-Dimethoxyphenyl)-α′-(1,3-benzodioxole-5-yl)tetrahydrofuran-3β,4β-dimethanol

(α′S)-2β-(3,4-ジメトキシフェニル)-α′-(1,3-ベンゾジオキソール-5-イル)テトラヒドロフラン-3β,4β-ジメタノール
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: C21H24O7
Molecular formula furigana: C21-H24-O7
Molecular weight: 388.416
InChI: InChI=1S/C21H24O7/c1-24-16-5-4-13(8-18(16)25-2)21-14(9-22)15(10-26-21)20(23)12-3-6-17-19(7-12)28-11-27-17/h3-8,14-15,20-23H,9-11H2,1-2H3/t14-,15-,20+,21-/m0/s1
InChI key: HUUOIIATKBSRCZ-YJPXFSGGSA-N
SMILES: COc1ccc(cc1OC)[C@@H]1OC[C@H]([C@H](O)c2ccc3OCOc3c2)[C@@H]1CO
Systematic name  (3):
  • (α′S)-2β-(3,4-ジメトキシフェニル)-α′-(1,3-ベンゾジオキソール-5-イル)テトラヒドロフラン-3β,4β-ジメタノール
  • (S)-(2H-1,3-ベンゾジオキソール-5-イル)[(3R,4R,5R)-5-(3,4-ジメトキシフェニル)-4-(ヒドロキシメチル)オキソラン-3-イル]メタノール
  • (S)-(2H-1,3-benzodioxol-5-yl)[(3R,4R,5R)-5-(3,4-dimethoxyphenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol
Other name (1):
  • (α′S)-2β-(3,4-Dimethoxyphenyl)-α′-(1,3-benzodioxole-5-yl)tetrahydrofuran-3β,4β-dimethanol
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