6A-Methyl-4-Pregnen-17A-Ol-20-One

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Properties Simple | Detailed

Formula C22H34O2
IUPAC Name 1-[(6s,8r,9s,10r,13s,14s,17r)-17-hydroxy-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone
Molecular Mass 330.504 g·mol−1
Heat of Formation -554.9 ± 16.7 kJ·mol−1
Dipole Moment 2.95 ± 1.08 D
Volume 430.21 Å 3
Surface Area 336.27 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy 3.89 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(6s,8r,9s,10r,13s,14s,17r)-17-hydroxy-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone
  • 17-hydroxy-6alpha-methyl-4-pregnen-20-on
  • 17-hydroxy-6alpha-methylpregn-4-en-20-one
  • anagestone
  • pregn-4-en-20-one, 17-hydroxy-6alpha-methyl-
CAS Number(s)
  • 2740-52-5
InChIKey GAIHSQSRHYQICG-DACBVQKSSA-N
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