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2-DECARBOXY-2-(P-METHYLPHOSPHINICO)-16-PHENOXYTETRANOR-PROSTAGLANDIN-F(2-ALPHA)-SODIUM-SALT
SpectraBase Compound ID 1PlBJp9qjCe
InChI InChI=1S/C28H39O9P.Na/c1-20(29)35-24(19-34-23-12-8-7-9-13-23)15-16-26-25(14-10-5-6-11-17-38(4,32)33)27(36-21(2)30)18-28(26)37-22(3)31;/h5,7-10,12-13,15-16,24-28H,6,11,14,17-19H2,1-4H3,(H,32,33);/q;+1/p-1/b10-5+,16-15+;/t24-,25+,26+,27-,28+;/m1./s1
InChIKey LGYZAWGXSDODRR-ITNGUHDWSA-M
Mol Weight 572.6 g/mol
Molecular Formula C28H38NaO9P
Exact Mass 572.215114 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5rT3cIwHbmV
Name 2-DECARBOXY-2-(P-METHYLPHOSPHINICO)-16-PHENOXYTETRANOR-PROSTAGLANDIN-F(2-ALPHA)-SODIUM-SALT
Compound Number 4B-S ODIUM-SALT
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H38NaO9P
InChI InChI=1S/C28H39O9P.Na/c1-20(29)35-24(19-34-23-12-8-7-9-13-23)15-16-26-25(14-10-5-6-11-17-38(4,32)33)27(36-21(2)30)18-28(26)37-22(3)31;/h5,7-10,12-13,15-16,24-28H,6,11,14,17-19H2,1-4H3,(H,32,33);/q;+1/p-1/b10-5+,16-15+;/t24-,25+,26+,27-,28+;/m1./s1
InChIKey LGYZAWGXSDODRR-ITNGUHDWSA-M
Literature Reference Author D.L.SOPER,J.B.J.MILBANK,G.E.MIELING,M.J.DIRR,A.S.KENDE,R.COO PER,W.S.S.JEE,W.YAO,
Literature Reference Citation J.MED.CHEM.,44,4157(2001)
Literature Reference DOI 10.1021/jm010264b
Solvent CDCl3
Source File Reference UWSI45313