Naphtho(2,3-C)Furan-1(3H)-One, 9-(1,3-Benzodioxol-5-Yl)-4-((4-O-β-D-Glucopyranosyl-2,3-Di-O-Methyl-β-D-Xylopyranosyl)Oxy)-6,7-Dimethoxy-

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Properties Simple | Detailed

Formula C17H6O16
IUPAC Name 3-buta-1,3-diynyldioxirane; molecular oxygen; (3s)-6'-(oxomethylene)spiro[2,8a-dihydropyrano[3,4-b][1,4]dioxine-3,2'-tetrahydropyran]-3',4',5',7,8-pentone
Molecular Mass 466.220 g·mol−1
Heat of Formation -2365.4 ± 16.7 kJ·mol−1
Dipole Moment 8.70 ± 1.08 D
Volume 767.36 Å 3
Surface Area 615.95 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
Synonyms
  • 4-(1,3-benzodioxol-5-yl)-9-[(2s,3r,4s,5r)-3,4-dimethoxy-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-oxan-2-yl]oxy-6,7-dimethoxy-1h-benzo[f][2]benzoxol-3-one
  • 4-(1,3-benzodioxol-5-yl)-9-[(2s,3r,4s,5r)-3,4-dimethoxy-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6,7-dimethoxy-1h-benzo[f][2]benzoxol-3-one
  • 4-(1,3-benzodioxol-5-yl)-9-[(2s,3r,4s,5r)-3,4-dimethoxy-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-6,7-dimethoxy-1h-benzo[f]isobenzofuran-3-one
  • 4-(1,3-benzodioxol-5-yl)-9-[(2s,3r,4s,5r)-3,4-dimethoxy-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-6,7-dimethoxy-1h-benzo[f]isobenzofuran-3-one
  • 4-(1,3-benzodioxol-5-yl)-9-[[(2s,3r,4s,5r)-3,4-dimethoxy-5-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-tetrahydropyranyl]oxy]-6,7-dimethoxy-1h-benzo[f]isobenzofuran-3-one
  • diphyllin-4-o-glucopyranosyl(1-4)-2,3-di-o-methylxylopyranoside
  • ramontoside
CAS Number(s)
  • 133882-75-4
InChIKey DDUSFSKGAHCYFG-LXOHQACASA-N
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