(7R,8R)-5,7-Dihydroxy-8-(2-Hydroxyphenyl)-2,2-Dimethyl-10-(3-Methyl-2-Buten-1-Yl)-7,8-Dihydro-2H,6H-Pyrano[3,2-G]Chromen-6-One

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Properties Simple | Detailed

Formula C25H26O6
IUPAC Name (7r,8r)-5,7-dihydroxy-8-(2-hydroxyphenyl)-2,2-dimethyl-10-(3-methylbut-2-enyl)-7,8-dihydropyrano[3,2-g]chromen-6-one
Molecular Mass 422.470 g·mol−1
Heat of Formation -873.7 ± 16.7 kJ·mol−1
Dipole Moment 3.94 ± 1.08 D
Volume 504.46 Å 3
Surface Area 396.38 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.42 ± eV
Point Group Symmetry C1
Synonyms
  • (7r,8r)-5,7-dihydroxy-8-(2-hydroxyphenyl)-2,2-dimethyl-10-(3-methylbut-2-enyl)-7,8-dihydropyrano[3,2-g]chromen-6-one
  • 3,5,2'-trihydroxy-6,7-(2'',2''-dimethylcromene)-8-(3''',3'''-dimethylallyl)-dihydroflavonol
  • 3,5-dihydroxy-2-(2-hydroxy-phenyl)-8,8-dimethyl-10-(3-methyl-but-2-enyl)-2,3-dihydro-8h-pyrano[3,2-g]chromen-4-one
  • jayacanol
  • rel-(7r,8r)-5,7-dihydroxy-8-(2-hydroxyphenyl)-2,2-dimethyl-10-(3-methylbut-2-en-1-yl)-7,8-dihydro-2h,6h-pyrano[3,2-g]chromen-6-one
InChIKey TTYWGXALMUZLQM-XUZZJYLKSA-N
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