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3.ALPHA.,11.BETA.,21-TRIHYDROXY-5.ALPHA.-PREGNAN-20-ONE
SpectraBase Compound ID 5fztsUvXatV
InChI InChI=1S/C21H34O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h12-17,19,22-24H,3-11H2,1-2H3/t12-,13+,14-,15-,16+,17-,19+,20-,21-/m0/s1
InChIKey RHQQHZQUAMFINJ-NZTKVECHSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 g/mol
Enantiomer InChIKey RHQQHZQUAMFINJ-OMXCTXDVSA-N
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Source of Spectrum Prof. Spiteller, University Bayreuth, Germany
  • 1-((3R,5S,8S,9S,10S,11S,13S,14S,17S)-3,11-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-hydroxyethanone
  • 3,11,21-TRIHYDROXYPREGNAN-20-ONE

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