Chem
J-GLOBAL ID：200907026876982861   Nikkaji number：J1.500.733H

β-D-Glucopyranose 1,6-bis(4-hydroxybenzoate)

β-D-グルコピラノース1,6-ビス(4-ヒドロキシベンゾアート)
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： C20H20O10
Molecular formula furigana： C20-H20-O10
Molecular weight： 420.370
InChI： InChI=1S/C20H20O10/c21-12-5-1-10(2-6-12)18(26)28-9-14-15(23)16(24)17(25)20(29-14)30-19(27)11-3-7-13(22)8-4-11/h1-8,14-17,20-25H,9H2/t14-,15-,16+,17-,20+/m1/s1
InChI key： ADUWFLANMQIDBE-XDCWJTEKSA-N
SMILES： O[C@H]1[C@H](O)[C@@H](COC(=O)c2ccc(O)cc2)O[C@@H](OC(=O)c2ccc(O)cc2)[C@@H]1O
Systematic name  (4)：
  • 1-O,6-O-ビス(4-ヒドロキシベンゾイル)-β-D-グルコピラノース
  • β-D-グルコピラノース1,6-ビス(4-ヒドロキシベンゾアート)
  • [(2R,3S,4S,5R,6S)-3,4,5-トリヒドロキシ-6-(4-ヒドロキシベンゾイルオキシ)オキサン-2-イル]メチル 4-ヒドロキシベンゾアート
  • [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxybenzoyloxy)oxan-2-yl]methyl 4-hydroxybenzoate
Other name (2)：
  • 1-O,6-O-Bis(4-hydroxybenzoyl)-β-D-glucopyranose
  • β-D-Glucopyranose 1,6-bis(4-hydroxybenzoate)
Thsaurus map：
Thesaurus Map

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