Azadirone

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Properties Simple | Detailed

Formula C28H36O4
IUPAC Name [(5r,7r,8r,9r,10r,13s,17r)-17-(3-furyl)-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-7-yl] acetate
Molecular Mass 436.583 g·mol−1
Heat of Formation -40.5 ± 16.7 kJ·mol−1
Dipole Moment 3.67 ± 1.08 D
Volume 543.85 Å 3
Surface Area 394.63 Å 2
Point Group Symmetry C1
Synonyms
  • [(5r,7r,8r,9r,10r,13s,17r)-17-(3-furyl)-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-7-yl] acetate
  • [(5r,7r,8r,9r,10r,13s,17r)-17-furan-3-yl-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-7-yl] acetate
  • [(5r,7r,8r,9r,10r,13s,17r)-17-furan-3-yl-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-7-yl] ethanoate
  • acetic acid [(5r,7r,8r,9r,10r,13s,17r)-17-(3-furyl)-3-keto-4,4,8,10,13-pentamethyl-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-7-yl] ester
  • acetic acid [(5r,7r,8r,9r,10r,13s,17r)-17-(3-furyl)-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-7-yl] ester
InChIKey XXIKKMLIDXLAIK-RFKFVWFBSA-N
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