Nomegestrol

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Properties Simple | Detailed

Formula C21H28O3
IUPAC Name (8s,9s,10r,13s,14s,17r)-17-acetyl-17-hydroxy-6,13-dimethyl-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Molecular Mass 328.445 g·mol−1
Heat of Formation -574.1 ± 16.7 kJ·mol−1
Dipole Moment 3.13 ± 1.08 D
Volume 411.64 Å 3
Surface Area 332.13 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C1
Synonyms
  • (8s,9s,10r,13s,14s,17r)-17-acetyl-17-hydroxy-6,13-dimethyl-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
  • (8s,9s,10r,13s,14s,17r)-17-ethanoyl-17-hydroxy-6,13-dimethyl-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
  • 17-hydroxy-6-methyl-19-nor-4,6-pregnadiene-3,20-dione
  • 17-hydroxy-6-methyl-19-norpregna-4,6-diene-3,20-dione
  • 19-norpregna-4,6-diene-3,20-dione, 17-hydroxy-6-methyl-
  • nomegestrolum [latin]
CAS Number(s)
  • 58691-88-6
InChIKey KZUIYQJTUIACIG-YBZCJVABSA-N
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