(8S,11R,13S,14S,17S)-11-(4-Acetylphenyl)-17-Hydroxy-13-Methyl-17-(1-Propyn-1-Yl)-1,2,6,7,8,11,12,13,14,15,16,17-Dodecahydro-3H-Cyclopenta[A]Phenanthren-3-One

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Formula C29H32O3
IUPAC Name (8s,11r,13s,14s,17s)-11-(4-acetylphenyl)-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Molecular Mass 428.563 g·mol−1
Heat of Formation 306.7 ± 16.7 kJ·mol−1
Dipole Moment 6.18 ± 1.08 D
Volume 531.98 Å 3
Surface Area 426.83 Å 2
Point Group Symmetry C1
Synonyms
  • (8s,11r,13s,14s,17s)-11-(4-acetylphenyl)-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
  • (8s,11r,13s,14s,17s)-11-(4-ethanoylphenyl)-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
  • estra-4,9-dien-3-one, 11-(4-acetylphenyl)-17-hydroxy-17-(1-propynyl)-, (11beta,17beta)-
  • zk 112,993
  • zk 112993
CAS Number(s)
  • 105114-63-4
InChIKey OPKMKRUFBKTTRF-GCNJZUOMSA-N
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