Spiro(Androstane-3,2'-Oxiran)-17-Ol, (3β,5Alpha,17β)-

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Formula C20H32O2
IUPAC Name (3s,5s,8r,9s,10s,13s,14s,17s)-10,13-dimethylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-oxirane]-17-ol
Molecular Mass 304.467 g·mol−1
Heat of Formation -459.9 ± 16.7 kJ·mol−1
Dipole Moment 2.96 ± 1.08 D
Volume 399.06 Å 3
Surface Area 314.1 Å 2
HOMO Energy -10.08 ± 0.55 eV
LUMO Energy 2.47 ± eV
Point Group Symmetry C1
Synonyms
  • (3s,5s,8r,9s,10s,13s,14s,17s)-10,13-dimethyl-17-spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-oxirane]ol
  • (3s,5s,8r,9s,10s,13s,14s,17s)-10,13-dimethylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-oxirane]-17-ol
CAS Number(s)
  • 2066-43-5
InChIKey YCSDPVROPBHVSJ-QFHQRVFTSA-N
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