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3-ALPHA-ACETOXY-17A-OXA-D-HOMO-5-ALPHA-ANDROSTAN-17-ONE
SpectraBase Compound ID BbiNtq6pkFz
InChI InChI=1S/C21H32O4/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17(20)9-11-21(3)18(16)6-7-19(23)25-21/h14-18H,4-12H2,1-3H3/t14-,15+,16+,17-,18-,20-,21-/m0/s1
InChIKey KCXUMZXWLRGXME-FEKDWZMTSA-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 GatQes2adgI
Name 3-ALPHA-ACETOXY-17A-OXA-D-HOMO-5-ALPHA-ANDROSTAN-17-ONE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O4
InChI InChI=1S/C21H32O4/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17(20)9-11-21(3)18(16)6-7-19(23)25-21/h14-18H,4-12H2,1-3H3/t14-,15+,16+,17-,18-,20-,21-/m0/s1
InChIKey KCXUMZXWLRGXME-FEKDWZMTSA-N
Literature Reference Author A.C.HUNTER,H.KHUENL-BRADY,P.BARRETT,H.T.DODD,C.DEDI
Literature Reference Citation J.ST.BIO.MOL.BIOL.,118,171(2010)
Literature Reference DOI 10.1016/j.jsbmb.2009.12.003
Molecular Weight 348.483 g/mol
Sample ID 68329
Solvent CDCl3