(3α,5Beta)-3-Hydroxy-10,17-Dimethylgon-13(17)-En-16-One

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Properties Simple | Detailed

Formula C19H28O2
IUPAC Name (3r,5r,8r,9s,10s,14s)-3-hydroxy-10,17-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1h-cyclopenta[a]phenanthren-16-one
Molecular Mass 288.424 g·mol−1
Heat of Formation -506.4 ± 16.7 kJ·mol−1
Dipole Moment 3.70 ± 1.08 D
Volume 371.05 Å 3
Surface Area 302.59 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy 0.13 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,5r,8r,9s,10s,14s)-3-hydroxy-10,17-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1h-cyclopenta[a]phenanthren-16-one
  • 18-norandrost-13(17)-en-16-one, 3-hydroxy-17-methyl-, (3alpha,5beta)-
  • 3-hydroxy-17-methyl-18-norandrost-13(17)-ene-16-one
  • 3alpha-hydroxy-17-methyl-18-nor-5beta-androst-13(17)-ene-16-one
CAS Number(s)
  • 81354-99-6
InChIKey DIRKPDDVEMEJPR-NOXHQTKFSA-N
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