9-(1,3-Benzodioxol-5-Yl)-4-(β-D-Glucopyranosyloxy)-6,7-Dimethoxynaphtho(2,3-C)Furan-1(3H)-One

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Properties Simple | Detailed

Formula C27H26O12
IUPAC Name 9-(6,7-dihydro-4h-1,3-benzodioxole-4,6,7-triid-5-yl)-6,7-di(methoxy)-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-3h-benzo[f]isobenzofuran-1-one
Molecular Mass 542.488 g·mol−1
Heat of Formation -240.2 ± 16.7 kJ·mol−1
Dipole Moment 6.85 ± 1.08 D
Volume 597.88 Å 3
Surface Area 478.52 Å 2
Point Group Symmetry C1
Synonyms
  • 4-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-9-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1h-benzo[f][2]benzoxol-3-one
  • 4-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-9-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-1h-benzo[f]isobenzofuran-3-one
  • 4-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-9-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-1h-benzo[f]isobenzofuran-3-one
  • 4-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-9-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-1h-benzo[f]isobenzofuran-3-one
  • cleistanthin b
CAS Number(s)
  • 30021-77-3
InChIKey BJGIWVGXMRUMNA-WBYCZGBQSA-N
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