2-(1-Hydroxy-4-Oxo-2,5-Cyclohexadien-1-Yl)Ethyl 6-O-[(2E)-3-Phenyl-2-Propenoyl]-β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C23H26O9
IUPAC Name [(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[2-(1-hydroxy-4-oxo-cyclohexa-2,5-dien-1-yl)ethoxy]tetrahydropyran-2-yl]methyl (e)-3-phenylprop-2-enoate
Molecular Mass 446.447 g·mol−1
Heat of Formation -1119.8 ± 16.7 kJ·mol−1
Dipole Moment 2.21 ± 1.08 D
Volume 516.74 Å 3
Surface Area 388.78 Å 2
Point Group Symmetry C1
Synonyms
  • (e)-3-phenylacrylic acid [(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[2-(1-hydroxy-4-keto-1-cyclohexa-2,5-dienyl)ethoxy]tetrahydropyran-2-yl]methyl ester
  • (e)-3-phenylprop-2-enoic acid [(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[2-(1-hydroxy-4-oxo-1-cyclohexa-2,5-dienyl)ethoxy]-2-tetrahydropyranyl]methyl ester
  • [(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[2-(1-hydroxy-4-oxo-1-cyclohexa-2,5-dienyl)ethoxy]oxan-2-yl]methyl (e)-3-phenylprop-2-enoate
  • [(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[2-(1-hydroxy-4-oxo-1-cyclohexa-2,5-dienyl)ethoxy]tetrahydropyran-2-yl]methyl (e)-3-phenylprop-2-enoate
InChIKey QOMDZDCUSAVCSJ-LPIGZASCSA-N
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