Ergosta-1,4-Dien-3-One, 22-(Acetyloxy)-24,25-Epoxy-7-Hydroxy-, (7α,22R)-

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Properties Simple | Detailed

Formula C30H44O5
IUPAC Name [(1r,2s)-2-[(7r,8s,9s,10r,13r,14s,17r)-7-hydroxy-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-1-[[(2r)-2,3,3-trimethyloxiran-2-yl]methyl]propyl] acetate
Molecular Mass 484.667 g·mol−1
Heat of Formation 694.4 ± 16.7 kJ·mol−1
Dipole Moment 4.57 ± 1.08 D
Volume 613.67 Å 3
Surface Area 455.45 Å 2
Point Group Symmetry C1
Synonyms
  • [(1r,2s)-2-[(7r,8s,9s,10r,13r,14s,17r)-7-hydroxy-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-1-[[(2r)-2,3,3-trimethyloxiran-2-yl]methyl]propyl] acetate
  • [(2r,3s)-3-[(7r,8s,9s,10r,13r,14s,17r)-7-hydroxy-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-1-[(2r)-2,3,3-trimethyloxiran-2-yl]butan-2-yl] acetate
  • [(2r,3s)-3-[(7r,8s,9s,10r,13r,14s,17r)-7-hydroxy-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-1-[(2r)-2,3,3-trimethyloxiran-2-yl]butan-2-yl] ethanoate
  • acetic acid [(1r,2s)-2-[(7r,8s,9s,10r,13r,14s,17r)-7-hydroxy-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-1-[[(2r)-2,3,3-trimethyl-2-oxiranyl]methyl]propyl] ester
  • acetic acid [(1r,2s)-2-[(7r,8s,9s,10r,13r,14s,17r)-7-hydroxy-3-keto-10,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-1-[[(2r)-2,3,3-trimethyloxiran-2-yl]methyl]propyl] ester
InChIKey FOOICJVUXQJOTQ-XYHXSBKBSA-N
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