Chem
J-GLOBAL ID:200907066771248269   Nikkaji number:J1.062.064C

3,4-Dimethoxy-5-hydroxyphenyl 2-O,3-O,4-O,6-O-tetraacetyl β-D-glucopyranoside

3,4-ジメトキシ-5-ヒドロキシフェニル2-O,3-O,4-O,6-O-テトラアセチルβ-D-グルコピラノシド
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: C22H28O13
Molecular formula furigana: C22-H28-O13
Molecular weight: 500.453
InChI: InChI=1S/C22H28O13/c1-10(23)30-9-17-19(31-11(2)24)20(32-12(3)25)21(33-13(4)26)22(35-17)34-14-7-15(27)18(29-6)16(8-14)28-5/h7-8,17,19-22,27H,9H2,1-6H3/t17-,19-,20+,21-,22-/m1/s1
InChI key: AHAJYZPHYKSCME-MIUGBVLSSA-N
SMILES: COc1cc(O[C@@H]2O[C@H](COC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]2OC(=O)C)cc(O)c1OC
Systematic name  (3):
  • 3,4-ジメトキシ-5-ヒドロキシフェニル2-O,3-O,4-O,6-O-テトラアセチルβ-D-グルコピラノシド
  • [(2R,3R,4S,5R,6S)-3,4,5-トリス(アセチルオキシ)-6-(3-ヒドロキシ-4,5-ジメトキシフェノキシ)オキサン-2-イル]メチル アセタート
  • [(2R,3R,4S,5R,6S)-3,4,5-tris(acetyloxy)-6-(3-hydroxy-4,5-dimethoxyphenoxy)oxan-2-yl]methyl acetate
Other name (1):
  • 3,4-Dimethoxy-5-hydroxyphenyl 2-O,3-O,4-O,6-O-tetraacetyl β-D-glucopyranoside
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