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3-BETA,5,16-BETA-TRIHYDROXY-6-OXO-5-ALPHA-DINORCHOLANIC-ACID-22->16-LACTONE
SpectraBase Compound ID FcrxU0QOek8
InChI InChI=1S/C22H32O5/c1-11-18-16(27-19(11)25)9-15-13-8-17(24)22(26)10-12(23)4-7-21(22,3)14(13)5-6-20(15,18)2/h11-16,18,23,26H,4-10H2,1-3H3/t11-,12-,13+,14-,15-,16-,18-,20-,21+,22-/m0/s1
InChIKey UFBDHLSEFZDMRO-VYRDSHTMSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H32O5
Exact Mass 376.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EwsWiXwxG7O
Name 3-BETA,5,16-BETA-TRIHYDROXY-6-OXO-5-ALPHA-DINORCHOLANIC-ACID-22->16-LACTONE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O5
InChI InChI=1S/C22H32O5/c1-11-18-16(27-19(11)25)9-15-13-8-17(24)22(26)10-12(23)4-7-21(22,3)14(13)5-6-20(15,18)2/h11-16,18,23,26H,4-10H2,1-3H3/t11-,12-,13+,14-,15-,16-,18-,20-,21+,22-/m0/s1
InChIKey UFBDHLSEFZDMRO-VYRDSHTMSA-N
Literature Reference Author A.ROSSADO-ABON,G.DEDIOS-BRAVO,R.RODRIGUEZ-SOTRES,M.A.ILESIAS -ARTEAGA
Literature Reference Citation J.ST.BIO.MOL.BIOL.,134,45(2013)
Literature Reference DOI 10.1016/j.jsbmb.2012.10.007
Molecular Weight 376.493 g/mol
Solvent DMSO-D6
Source File Reference UWLU78585