Chem
J-GLOBAL ID:201207077786841192   Nikkaji number:J3.118.497E

3,5-Dimethoxy-4-hydroxybenzeneacrylic acid 2-O,3-O,4-O,6-O-tetraacetyl-β-D-glucopyranosyl ester

3,5-ジメトキシ-4-ヒドロキシベンゼンアクリル酸2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシル
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: C25H30O14
Molecular formula furigana: C25-H30-O14
Molecular weight: 554.501
InChI: InChI=1S/C25H30O14/c1-12(26)34-11-19-22(35-13(2)27)23(36-14(3)28)24(37-15(4)29)25(38-19)39-20(30)8-7-16-9-17(32-5)21(31)18(10-16)33-6/h7-10,19,22-25,31H,11H2,1-6H3/t19-,22-,23+,24-,25+/m1/s1
InChI key: OVDHLKVANAGJCA-HKNOCEQDSA-N
SMILES: COc1cc(C=CC(=O)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(OC)c1O
Systematic name  (3):
  • 3,5-ジメトキシ-4-ヒドロキシベンゼンアクリル酸2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシル
  • (2S,3R,4S,5R,6R)-3,4,5-トリス(アセチルオキシ)-6-[(アセチルオキシ)メチル]オキサン-2-イル 3-(4-ヒドロキシ-3,5-ジメトキシフェニル)プロパ-2-エノアート
  • (2S,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate
Other name (1):
  • 3,5-Dimethoxy-4-hydroxybenzeneacrylic acid 2-O,3-O,4-O,6-O-tetraacetyl-β-D-glucopyranosyl ester
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