Chem
J-GLOBAL ID:201907019254990809   Nikkaji number:J3.737.151C

[(3aR,6R,6aR)-6-[(benzoyloxy)methyl]-2,2-diethyl-4-hydroxy-dihydro-3aH-furo[3,4-d][1,3]dioxol-4-yl]methyl benzoate

[(3aR,6R,6aR)-6-[(ベンゾイルオキシ)メチル]-2,2-ジエチル-4-ヒドロキシ-ジヒドロ-3aH-フロ[3,4-d][1,3]ジオキソール-4-イル]メチルベンゾアート
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: C25H28O8
Molecular formula furigana: C25-H28-O8
Molecular weight: 456.491
InChI: InChI=1S/C25H28O8/c1-3-24(4-2)32-20-19(15-29-22(26)17-11-7-5-8-12-17)31-25(28,21(20)33-24)16-30-23(27)18-13-9-6-10-14-18/h5-14,19-21,28H,3-4,15-16H2,1-2H3/t19-,20-,21-,25?/m1/s1
InChI key: QDKVZWNGSDRCSN-FDBHIMERSA-N
SMILES: O(C[C@H]1OC(O)(COC(=O)c2ccccc2)[C@@H]2OC(O[C@H]12)(CC)CC)C(=O)c1ccccc1
Systematic name  (3):
  • 1-O,6-O-ジベンゾイル-3-O,4-O-(1-エチルプロピリデン)-D-プシコフラノース
  • [(3aR,6R,6aR)-6-[(ベンゾイルオキシ)メチル]-2,2-ジエチル-4-ヒドロキシ-テトラヒドロ-2H-フロ[3,4-d][1,3]ジオキソール-4-イル]メチルベンゾアート
  • [(3aR,6R,6aR)-6-[(benzoyloxy)methyl]-2,2-diethyl-4-hydroxy-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]methyl benzoate
Other name (2):
  • [(3aR,6R,6aR)-6-[(ベンゾイルオキシ)メチル]-2,2-ジエチル-4-ヒドロキシ-ジヒドロ-3aH-フロ[3,4-d][1,3]ジオキソール-4-イル]メチルベンゾアート
  • [(3aR,6R,6aR)-6-[(benzoyloxy)methyl]-2,2-diethyl-4-hydroxy-dihydro-3aH-furo[3,4-d][1,3]dioxol-4-yl]methyl benzoate
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