(2S,6Ar,11Ar)-2-Isopropenyl-1,2-Dihydro-6H-[1]Benzofuro[3,2-C]Furo[3,2-G]Chromene-6A,9(11Ah)-Diol

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Formula C20H18O5
IUPAC Name (2s,6ar,11ar)-2-isopropenyl-1,2-dihydro-6h-[1]benzofuro[3,2-c]furo[3,2-g]chromene-6a,9(11ah)-diol
Molecular Mass 338.354 g·mol−1
Heat of Formation -594.5 ± 16.7 kJ·mol−1
Dipole Moment 2.64 ± 1.08 D
Volume 382.72 Å 3
Surface Area 336.06 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy 2.93 ± eV
Point Group Symmetry C1
Synonyms
  • 6h-benzofuro(3,2-c)furo(3,2-g)(1)benzopyran-6a,9(11ah)-diol, 1,2-dihydro-2-(1-methylethenyl)-, (2s-(2alpha,6aalpha,11aalpha))-
  • glyceollin iii
CAS Number(s)
  • 61080-23-7
InChIKey MIYTVBARXCVVHZ-BEVDRBHNSA-N
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