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(4S,5S,7R,8R,9R,10S,16R)-4-BETA,20-DI-(ACETOXYMETHYL)-13,16-ALPHA-DI-(PHENYLTHIO)-21-NORPICRAS-13-ENE
SpectraBase Compound ID A7B0HEsFNn7
InChI InChI=1S/C36H44O5S2/c1-24(37)39-22-34(3)18-11-19-35(4)30-17-16-29(42-26-12-7-5-8-13-26)28-20-33(43-27-14-9-6-10-15-27)41-32(21-31(34)35)36(28,30)23-40-25(2)38/h5-10,12-15,30-33H,11,16-23H2,1-4H3/t30-,31?,32-,33+,34-,35-,36+/m1/s1
InChIKey WEFDECAECBZIBM-WLHNGJHVSA-N
Mol Weight 620.9 g/mol
Molecular Formula C36H44O5S2
Exact Mass 620.263017 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GrRZ4Encuzx
Name (4S,5S,7R,8R,9R,10S,16R)-4-BETA,20-DI-(ACETOXYMETHYL)-13,16-ALPHA-DI-(PHENYLTHIO)-21-NORPICRAS-13-ENE
Compound Number 22B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H44O5S2
InChI InChI=1S/C36H44O5S2/c1-24(37)39-22-34(3)18-11-19-35(4)30-17-16-29(42-26-12-7-5-8-13-26)28-20-33(43-27-14-9-6-10-15-27)41-32(21-31(34)35)36(28,30)23-40-25(2)38/h5-10,12-15,30-33H,11,16-23H2,1-4H3/t30-,31?,32-,33+,34-,35-,36+/m1/s1
InChIKey WEFDECAECBZIBM-WLHNGJHVSA-N
Literature Reference Author A.F.BARRERO,E.J.ALVAREZ-MANZANEDA,R.ALVAREZ-MANZANEDA,R.CHAH BOUN,R.MENESES,J.M.C
Literature Reference Citation ORG.LETTERS,3,647(2001)
Literature Reference DOI 10.1021/ol0065322
Molecular Weight 620.862 g/mol
Solvent CDCl3
Source File Reference UWVN32541