(7As,12As)-3,3-Dimethyl-3H,7H-[1]Benzofuro[3,2-C]Pyrano[3,2-G]Chromene-7A,10(12Ah)-Diol

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Formula C20H18O5
IUPAC Name (2s,10s)-17,17-dimethyl-3,12,16-trioxapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),4(9),5,7,14,18,20-heptaene-6,10-diol
Molecular Mass 338.354 g·mol−1
Heat of Formation -645.2 ± 16.7 kJ·mol−1
Dipole Moment 0.26 ± 1.08 D
Volume 382.23 Å 3
Surface Area 335.0 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy 2.79 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-glyceollin ii
CAS Number(s)
  • 67314-98-1
InChIKey DDJVLBCETGUEBO-AZUAARDMSA-N
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Elements H C O