(5As,6R,7R,9As)-6-{2-[(4Ar,6R,8As)-6-Hydroxy-2,5,5,8A-Tetramethyl-3-Oxo-3,4,4A,5,6,7,8,8A-Octahydro-1-Naphthalenyl]Ethyl}-2,2,5A,7-Tetramethyloctahydro-1-Benzoxepin-3(2H)-One

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Properties Simple | Detailed

Formula C30H48O4
IUPAC Name (5as,6r,7r,9as)-6-[2-[(4ar,6r,8as)-6-hydroxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4h-naphthalen-1-yl]ethyl]-2,2,5a,7-tetramethyl-5,6,7,8,9,9a-hexahydro-4h-benzo[b]oxepin-3-one
Molecular Mass 472.700 g·mol−1
Heat of Formation 560.9 ± 16.7 kJ·mol−1
Dipole Moment 1.16 ± 1.08 D
Volume 601.41 Å 3
Surface Area 447.28 Å 2
Point Group Symmetry C1
Synonyms
  • (5as,6r,7r,9as)-6-[2-[(4ar,6r,8as)-6-hydroxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4h-naphthalen-1-yl]ethyl]-2,2,5a,7-tetramethyl-5,6,7,8,9,9a-hexahydro-4h-benzo[f]oxepin-3-one
  • (5as,6r,7r,9as)-6-[2-[(4ar,6r,8as)-6-hydroxy-3-keto-2,5,5,8a-tetramethyl-4a,6,7,8-tetrahydro-4h-naphthalen-1-yl]ethyl]-2,2,5a,7-tetramethyl-5,6,7,8,9,9a-hexahydro-4h-benzo[f]oxepin-3-one
CAS Number(s)
  • 172854-78-3
InChIKey LKIOGCBOOOKUTG-CCBATZBESA-N
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