4-(1,3-Benzodioxol-5-Yl)-6-Hydroxy-1-Oxo-1,3-Dihydronaphtho[2,3-C]Furan-5-Yl β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C25H22O11
IUPAC Name 4-(6,7-dihydro-1,3-benzodioxole-6,7-diid-5-yl)-1-oxo-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-3h-benzo[f]isobenzofuran-6-olate
Molecular Mass 498.436 g·mol−1
Heat of Formation -883.5 ± 16.7 kJ·mol−1
Dipole Moment 2.67 ± 1.08 D
Volume 521.2 Å 3
Surface Area 389.44 Å 2
Point Group Symmetry C1
Synonyms
  • 9-(1,3-benzodioxol-5-yl)-7-hydroxy-8-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1h-benzo[f][2]benzoxol-3-one
  • 9-(1,3-benzodioxol-5-yl)-7-hydroxy-8-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-1h-benzo[f]isobenzofuran-3-one
  • 9-(1,3-benzodioxol-5-yl)-7-hydroxy-8-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-1h-benzo[f]isobenzofuran-3-one
  • 9-(1,3-benzodioxol-5-yl)-7-hydroxy-8-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-1h-benzo[f]isobenzofuran-3-one
InChIKey TXLXNBLWYBIYQL-FHBCLOHASA-N
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