Chem
J-GLOBAL ID：200907008765308004
Nikkaji number：J1.680.630G
(3R,4S)-3-(1,3-Benzodioxole-5-ylcarbonyl)-4-(1,3-benzodioxole-5-ylmethyl)tetrahydrofuran-2-one
(3R,4S)-3-(1,3-ベンゾジオキソール-5-イルカルボニル)-4-(1,3-ベンゾジオキソール-5-イルメチル)テトラヒドロフラン-2-オン
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
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
Molecular formula： C20H16O7
Molecular formula furigana： C20-H16-O7
Molecular weight： 368.341
InChI：
InChI=1S/C20H16O7/c21-19(12-2-4-15-17(7-12)27-10-25-15)18-13(8-23-20(18)22)5-11-1-3-14-16(6-11)26-9-24-14/h1-4,6-7,13,18H,5,8-10H2/t13-,18-/m1/s1
InChI key：
NJTZMJYMSGEBJC-FZKQIMNGSA-N
SMILES：
O=C([C@H]1[C@H](Cc2ccc3OCOc3c2)COC1=O)c1ccc2OCOc2c1
Systematic name (3)：
- (3R,4S)-3-(1,3-ベンゾジオキソール-5-イルカルボニル)-4-(1,3-ベンゾジオキソール-5-イルメチル)テトラヒドロフラン-2-オン
- (3R,4S)-4-[(2H-1,3-ベンゾジオキソール-5-イル)メチル]-3-(2H-1,3-ベンゾジオキソール-5-カルボニル)オキソラン-2-オン
- (3R,4S)-4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(2H-1,3-benzodioxole-5-carbonyl)oxolan-2-one
- (3R,4S)-3-(1,3-Benzodioxole-5-ylcarbonyl)-4-(1,3-benzodioxole-5-ylmethyl)tetrahydrofuran-2-one
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