15-Oxopuupehenol

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Properties Simple | Detailed

Formula C21H28O4
IUPAC Name (4as,6as,12ar,12bs)-9,10-dihydroxy-4,4,6a,12b-tetramethyl-2,3,4a,5,6,12a-hexahydro-1h-benzo[a]xanthen-12-one
Molecular Mass 344.445 g·mol−1
Heat of Formation -786.9 ± 16.7 kJ·mol−1
Dipole Moment 5.03 ± 1.08 D
Volume 414.76 Å 3
Surface Area 327.4 Å 2
HOMO Energy -8.63 ± 0.55 eV
LUMO Energy 2.46 ± eV
Point Group Symmetry C1
Synonyms
  • (4as,6as,12ar,12bs)-9,10-dihydroxy-4,4,6a,12b-tetramethyl-1,2,3,4,4a,5,6,6a,12a,12b-decahydro-benzo[!]xanthen-12-one
  • (4as,6as,12ar,12bs)-9,10-dihydroxy-4,4,6a,12b-tetramethyl-2,3,4a,5,6,12a-hexahydro-1h-benzo[a]xanthen-12-one
InChIKey UVKYMKMZOUXEAN-OFCAXSSNSA-N
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