(1S,3E,5R,7R)-3-[(3,4-Dihydroxyphenyl)(Hydroxy)Methylene]-1-[(2S)-2-Isopropenyl-5-Methyl-4-Hexen-1-Yl]-6,6-Dimethyl-5,7-Bis(3-Methyl-2-Buten-1-Yl)Bicyclo[3.3.1]Nonane-2,4,9-Trione

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Formula C38H50O6
IUPAC Name (1s,3e,5r,7r)-3-[(3,4-dihydroxyphenyl)-hydroxy-methylene]-1-[(2s)-2-isopropenyl-5-methyl-hex-4-enyl]-6,6-dimethyl-5,7-bis(3-methylbut-2-enyl)bicyclo[3.3.1]nonane-2,4,9-trione
Molecular Mass 602.800 g·mol−1
Heat of Formation -1048.3 ± 16.7 kJ·mol−1
Dipole Moment 2.40 ± 1.08 D
Volume 775.96 Å 3
Surface Area 508.42 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 2.29 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,3e,5s,7r)-3-[(3,4-dihydroxyphenyl)-hydroxy-methylene]-5-[(2s)-2-isopropenyl-5-methyl-hex-4-enyl]-8,8-dimethyl-1,7-bis(3-methylbut-2-enyl)bicyclo[3.3.1]nonane-2,4,9-trione
  • (1r,3e,5s,7r)-3-[(3,4-dihydroxyphenyl)-hydroxy-methylidene]-8,8-dimethyl-1,7-bis(3-methylbut-2-enyl)-5-[(2s)-5-methyl-2-prop-1-en-2-yl-hex-4-enyl]bicyclo[3.3.1]nonane-2,4,9-trione
  • (1r,3e,5s,7r)-3-[(3,4-dihydroxyphenyl)-hydroxymethylene]-5-[(2s)-2-isopropenyl-5-methylhex-4-enyl]-8,8-dimethyl-1,7-bis(3-methylbut-2-enyl)bicyclo[3.3.1]nonane-2,4,9-trione
  • bicyclo(3.3.1)non-3-ene-2,9-dione, 3-(3,4-dihydroxybenzoyl)-4-hydroxy-8,8-dimethyl-1,7-bis(3-methyl-2-butenyl)-5-(5-methyl-2-(1-methylethenyl)-4-hexenyl)-, (1r-(1alpha,5alpha,5(s*),7beta))-
  • camboginol
InChIKey DTTONLKLWRTCAB-UDFURZHRSA-N
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