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Methyl-(5Z,13E,8R,9S,11R,12S,15S)-11,15-bis-(tert.-butyldimethylsiloxy)-9-methylamino)-8-(phenylsulfonyl)-5,13-prostadie
SpectraBase Compound ID 4q3FFZbBJuz
InChI InChI=1S/C40H71NO6SSi2/c1-14-15-19-24-32(46-49(10,11)38(2,3)4)28-29-34-35(47-50(12,13)39(5,6)7)31-36(41-8)40(34,30-23-17-16-22-27-37(42)45-9)48(43,44)33-25-20-18-21-26-33/h17-18,20-21,23,25-26,28-29,32,34-36,41H,14-16,19,22,24,27,30-31H2,1-13H3/b23-17+,29-28+
InChIKey KHNSDFNGXNCXCP-MHJNODFFSA-N
Mol Weight 750.2 g/mol
Molecular Formula C40H71NO6SSi2
Exact Mass 749.454063 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LyP21Wc2XH7
Name Methyl-(5Z,13E,8R,9S,11R,12S,15S)-11,15-bis-(tert.-butyldimethylsiloxy)-9-methylamino)-8-(phenylsulfonyl)-5,13-prostadie
CAS Registry Number 77494-47-4
Comments reassigned
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Formula C40H71NO6SSi2
InChI InChI=1S/C40H71NO6SSi2/c1-14-15-19-24-32(46-49(10,11)38(2,3)4)28-29-34-35(47-50(12,13)39(5,6)7)31-36(41-8)40(34,30-23-17-16-22-27-37(42)45-9)48(43,44)33-25-20-18-21-26-33/h17-18,20-21,23,25-26,28-29,32,34-36,41H,14-16,19,22,24,27,30-31H2,1-13H3/b23-17+,29-28+
InChIKey KHNSDFNGXNCXCP-MHJNODFFSA-N
Instrument Name SF = 080 MHz
Literature Reference J. Org. Chem. 48, 2167 (1983).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3