(10R,11S,12S)-12-Hydroxy-6,6,10,11-Tetramethyl-4-Phenyl-11,12-Dihydro-2H,6H,10H-Dipyrano[2,3-F:2',3'-H]Chromen-2-One

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Properties Simple | Detailed

Formula C25H24O5
IUPAC Name (10r,11s,12s)-12-hydroxy-6,6,10,11-tetramethyl-4-phenyl-11,12-dihydro-2h,6h,10h-dipyrano[2,3-f:2',3'-h]chromen-2-one
Molecular Mass 404.455 g·mol−1
Heat of Formation -686.5 ± 16.7 kJ·mol−1
Dipole Moment 7.08 ± 1.08 D
Volume 473.05 Å 3
Surface Area 380.49 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.68 ± eV
Point Group Symmetry C1
Synonyms
  • (3s,4s,2r)-4-hydroxy-2,3,10,10-tetramethyl-8-phenyl-2h-pyrano[6,5-f]2h-pyrano[6,5-h]chroman-6-one
  • 2h,6h,10h-benzo(1,2-b:3,4-b':5,6-b'')tripyran-2-one, 11,12-dihydro-12-hydroxy-6,6,10,11-tetramethyl-4-phenyl-, (10alpha,11beta,12alpha)-(+)-
  • inophyllum b
CAS Number(s)
  • 41135-06-2
InChIKey BXENDTPSKAICGV-LKBUQDJMSA-N
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