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3.BETA.,17.ALPHA.,20.BETA.,21-TETRAHYDROXY-5.ALPHA.-PREGNANE
SpectraBase Compound ID 4ubH97ikrum
InChI InChI=1S/C21H36O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h13-18,22-25H,3-12H2,1-2H3/t13-,14-,15+,16-,17-,18-,19-,20-,21-/m0/s1
InChIKey MQSSTQLJJOVNQF-AFYPPJMBSA-N
Mol Weight 352.5 g/mol
Molecular Formula C21H36O4
Exact Mass 352.26136 g/mol
Enantiomer InChIKey MQSSTQLJJOVNQF-WIUGXYOTSA-N
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Source of Spectrum Prof. Spiteller, University Bayreuth, Germany
  • (3S,5S,8R,9S,10S,13S,14S,17R)-17-((S)-1,2-dihydroxyethyl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
  • 5.ALPHA.-PREGNANE-3.BETA.,17.ALPHA.,20.BETA.,21-TETROL
  • PREGNANE-3,17,20,21-TETROL

This compound is available in the following databases:

Mass Spectra of Physiologically Active Substances - including drugs, steroid hormones,and endocrine disruptors 2011

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