Colpormon

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Properties Simple | Detailed

Formula C22H26O5
IUPAC Name [(8r,9s,13s,14s,16r)-16-acetoxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-3-yl] acetate
Molecular Mass 370.439 g·mol−1
Heat of Formation -899.0 ± 16.7 kJ·mol−1
Dipole Moment 3.60 ± 1.08 D
Volume 441.54 Å 3
Surface Area 377.85 Å 2
HOMO Energy -9.25 ± 0.55 eV
LUMO Energy 0.10 ± eV
Point Group Symmetry C1
Synonyms
  • (16alpha)-3,16-bis(acetyloxy)estra-1,3,5(10)-trien-17-one
  • 16alpha-hydroxyestron-diacetat
  • 3,16alpha-dihydroxyestra-1,3,5(10)-trien-17-one 3,16-diacetate
  • [(8r,9s,13s,14s,16r)-3-acetoxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-16-yl] acetate
  • [(8r,9s,13s,14s,16r)-3-acetyloxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-16-yl] acetate
  • [(8r,9s,13s,14s,16r)-3-acetyloxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-16-yl] ethanoate
  • acetic acid [(8r,9s,13s,14s,16r)-3-acetoxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-16-yl] ester
  • acetic acid [(8r,9s,13s,14s,16r)-3-acetoxy-17-keto-13-methyl-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-16-yl] ester
  • colpogynon
CAS Number(s)
  • 1247-71-8
InChIKey QZQSENRWYLQIPC-JPVHLGFFSA-N
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