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3-BETA,7-BETA,12-BETA-TRIHYDROXY-PREGN-5-EN-20-ONE
SpectraBase Compound ID Dr7gccjDAH6
InChI InChI=1S/C21H32O4/c1-11(22)14-4-5-15-19-16(10-18(25)21(14,15)3)20(2)7-6-13(23)8-12(20)9-17(19)24/h9,13-19,23-25H,4-8,10H2,1-3H3/t13-,14+,15-,16-,17-,18+,19-,20-,21+/m0/s1
InChIKey CTOWRRBKBQSDMG-UFIOCQEHSA-N
Mol Weight 348.5 g/mol
Molecular Formula C21H32O4
Exact Mass 348.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8tGSCQeY7O0
Name 3-BETA,7-BETA,12-BETA-TRIHYDROXY-PREGN-5-EN-20-ONE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O4
InChI InChI=1S/C21H32O4/c1-11(22)14-4-5-15-19-16(10-18(25)21(14,15)3)20(2)7-6-13(23)8-12(20)9-17(19)24/h9,13-19,23-25H,4-8,10H2,1-3H3/t13-,14+,15-,16-,17-,18+,19-,20-,21+/m0/s1
InChIKey CTOWRRBKBQSDMG-UFIOCQEHSA-N
Literature Reference Author A.C.HUNTER,P.W.MILLS,C.DEDI,H.T.DODD
Literature Reference Citation J.ST.BIO.MOL.BIOL.,108,155(2008)
Literature Reference DOI 10.1016/j.jsbmb.2007.09.022
Molecular Weight 348.483 g/mol
Solvent C5D5N
Source File Reference UWLU80604