(10R,11S,12R)-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,12r)-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 -696.7 ± 16.7 kJ·mol−1
Dipole Moment 5.87 ± 1.08 D
Volume 471.9 Å 3
Surface Area 380.29 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
Synonyms
  • (3s,2r,4r)-4-hydroxy-2,3,10,10-tetramethyl-8-phenyl-2h-pyrano(6,5-f)2h-pyrano(6,5-h)chroman-6-one
  • (3s,2r,4r)-4-hydroxy-2,3,10,10-tetramethyl-8-phenyl-2h-pyrano[6,5-f]2h-pyrano[6,5-h]chroman-6-one
  • inophyllum p
  • soullatrolide
CAS Number(s)
  • 152187-38-7
InChIKey BXENDTPSKAICGV-ZMOMAAQPSA-N
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