(3E,17α)-3-{[3-(Dimethylamino)Propoxy]Imino}-19-Norpregn-4-En-20-Yn-17-Ol

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Formula C25H38N2O2
IUPAC Name (3e,8r,9s,10r,13s,14s,17r)-3-[3-(dimethylamino)propoxyimino]-17-ethynyl-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
Molecular Mass 398.581 g·mol−1
Heat of Formation -78.2 ± 16.7 kJ·mol−1
Dipole Moment 2.73 ± 1.08 D
Volume 523.54 Å 3
Surface Area 439.86 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 0.32 ± eV
Point Group Symmetry C1
Synonyms
  • (3e,8r,9s,10r,13s,14s,17r)-3-(3-dimethylaminopropoxyimino)-17-ethynyl-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
  • 19-norpregn-4-en-20-yn-3-one, 17-hydroxy-, (3-(dimethylamino)propyl)oxime, (17alpha)-
  • norethindrone 3-(o-dimethylaminopropyl)oxime
CAS Number(s)
  • 66841-21-2
InChIKey SYGKSBXFYOWNQM-RWCLIDKWSA-N
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