(2S,4As,5R,6R,8Ar)-5-[(3R)-3-Hydroxy-3-Methyl-4-Penten-1-Yl]-1,1,4A,6-Tetramethyldecahydro-2,6-Naphthalenediol

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Formula C20H36O3
IUPAC Name (2s,4as,5r,6r,8ar)-5-[(3r)-3-hydroxy-3-methyl-pent-4-enyl]-1,1,4a,6-tetramethyl-decalin-2,6-diol
Molecular Mass 324.498 g·mol−1
Heat of Formation -788.5 ± 16.7 kJ·mol−1
Dipole Moment 1.64 ± 1.08 D
Volume 437.63 Å 3
Surface Area 337.9 Å 2
HOMO Energy -10.01 ± 0.55 eV
LUMO Energy 0.69 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,2r,4ar,6s,8as)-1-[(3r)-3-hydroxy-3-methyl-pent-4-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1h-naphthalene-2,6-diol
  • (1r,2r,4ar,6s,8as)-1-[(3r)-3-hydroxy-3-methylpent-4-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1h-naphthalene-2,6-diol
  • (2s,4as,5r,6r,8ar)-5-[(3r)-3-hydroxy-3-methyl-pent-4-enyl]-1,1,4a,6-tetramethyl-decalin-2,6-diol
  • (2s,4as,5r,6r,8ar)-5-[(3r)-3-hydroxy-3-methylpent-4-enyl]-1,1,4a,6-tetramethyldecalin-2,6-diol
  • 3-hydroxysclareol
CAS Number(s)
  • 132796-57-7
InChIKey GHXNUBMJNAHZRP-CJEFFJQMSA-N
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