Machaeriol B

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Properties Simple | Detailed

Formula C24H26O3
IUPAC Name (6as,9s,10as)-3-(benzofuran-2-yl)-6,6,9-trimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol
Molecular Mass 362.461 g·mol−1
Heat of Formation -392.0 ± 16.7 kJ·mol−1
Dipole Moment 1.88 ± 1.08 D
Volume 438.54 Å 3
Surface Area 379.07 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy -0.72 ± eV
Point Group Symmetry C1
Synonyms
  • (6as,9s,10as)-3-(1-benzofuran-2-yl)-6,6,9-trimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol
  • (6as,9s,10as)-3-(2-benzofuranyl)-6,6,9-trimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol
  • (6as,9s,10as)-3-(benzofuran-2-yl)-6,6,9-trimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol
InChIKey HCVQRSCZRRQWTK-WBAXXEDZSA-N
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