Chem
J-GLOBAL ID：200907031258546469   Nikkaji number：J865.544H

(-)-Virgatusin

(-)-ビルガツシン
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： C23H28O7
Molecular formula furigana： C23-H28-O7
Molecular weight： 416.470
InChI： InChI=1S/C23H28O7/c1-24-11-16-17(12-25-2)23(15-6-8-19-21(10-15)29-13-28-19)30-22(16)14-5-7-18(26-3)20(9-14)27-4/h5-10,16-17,22-23H,11-13H2,1-4H3/t16-,17-,22+,23-/m1/s1
InChI key： OGTJJRNJLHLKFF-ROEJJBDBSA-N
SMILES： COC[C@@H]1[C@@H](COC)[C@@H](O[C@@H]1c1ccc2OCOc2c1)c1ccc(OC)c(OC)c1
Systematic name  (4)：
  • 5-[[3α,4β-ビス(メトキシメチル)-5α-(3,4-ジメトキシフェニル)テトラヒドロフラン]-2α-イル]-1,3-ベンゾジオキソール
  • 5-[(2S)-3α,4β-ビス(メトキシメチル)-5α-(3,4-ジメトキシフェニル)オキソラン-2α-イル]-1,3-ベンゾジオキソール
  • 5-[(2S,3S,4S,5R)-5-(3,4-ジメトキシフェニル)-3,4-ビス(メトキシメチル)オキソラン-2-イル]-2H-1,3-ベンゾジオキソール
  • 5-[(2S,3S,4S,5R)-5-(3,4-dimethoxyphenyl)-3,4-bis(methoxymethyl)oxolan-2-yl]-2H-1,3-benzodioxole
Other name (4)：
  • 5-[[3α,4β-Bis(methoxymethyl)-5α-(3,4-dimethoxyphenyl)tetrahydrofuran]-2α-yl]-1,3-benzodioxole
  • 5-[(2S)-3α,4β-Bis(methoxymethyl)-5α-(3,4-dimethoxyphenyl)oxolane-2α-yl]-1,3-benzodioxole
  • (-)-ビルガツシン
  • (-)-Virgatusin
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