Tetrahydrodeoxycorticosterone

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Properties Simple | Detailed

Formula C21H34O3
IUPAC Name 2-hydroxy-1-[(3r,5s,8r,9s,10s,13s,14s,17s)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl]ethanone
Molecular Mass 334.493 g·mol−1
Heat of Formation -776.6 ± 16.7 kJ·mol−1
Dipole Moment 1.45 ± 1.08 D
Volume 430.23 Å 3
Surface Area 336.33 Å 2
HOMO Energy -10.18 ± 0.55 eV
LUMO Energy 0.50 ± eV
Point Group Symmetry C1
Synonyms
  • 2-hydroxy-1-[(3r,5s,8r,9s,10s,13s,14s,17s)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl]ethanone
  • 21-hydroxyallopregnanolone
  • 3alpha,21-dihydroxy-5alpha-pregnan-20-one
  • 5-alpha-thdoc
  • 5alpha-pregnane-3alpha,21-diol-20-one
  • 5alpha-thdoc
  • allopregnane-3alpha,21-diol-20-one
  • allotetrahydrodeoxycorticosterone
  • biomol-nt_000267
  • bpbio1_000772
InChIKey CYKYBWRSLLXBOW-GDYGHMJCSA-N
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Elements H C O