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(20S)-18-JODOPREGN-5-ENE-3-BETA,20-DIOL-3-ACETATE
SpectraBase Compound ID EfzJgBjpzx2
InChI InChI=1S/C23H35IO3/c1-14(25)19-6-7-21-18-5-4-16-12-17(27-15(2)26)8-10-22(16,3)20(18)9-11-23(19,21)13-24/h4,14,17-21,25H,5-13H2,1-3H3/t14-,17+,18-,19-,20+,21+,22+,23+/m1/s1
InChIKey SHRXHVQGOCEPEI-UYMPYPSOSA-N
Mol Weight 486.4 g/mol
Molecular Formula C23H35IO3
Exact Mass 486.16309 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6SXCh3Zh8xB
Name (20S)-18-JODOPREGN-5-ENE-3-BETA,20-DIOL-3-ACETATE
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H35IO3
InChI InChI=1S/C23H35IO3/c1-14(25)19-6-7-21-18-5-4-16-12-17(27-15(2)26)8-10-22(16,3)20(18)9-11-23(19,21)13-24/h4,14,17-21,25H,5-13H2,1-3H3/t14-,17+,18-,19-,20+,21+,22+,23+/m1/s1
InChIKey SHRXHVQGOCEPEI-UYMPYPSOSA-N
Literature Reference Author P.DEARMAS,J.I.CONCEPCION,C.G.FRANCISCO,R.HERNANDEZ,J.A.SALAZ AR,E.SUAREZ
Literature Reference Citation J.CHEM.SOC.PERKIN-1,405(1989)
Literature Reference DOI 10.1039/p19890000405
Molecular Weight 486.434 g/mol
Solvent CDCl3
Source File Reference UWBK1424