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2,2'-ANHYDRO-1-[3-BENZYL-5-O-(METHYLSULFONYL)-4-C-(METHYLSULFONYLOXYMETHYL)-ALPHA-L-ERYTHRO-PENTOFURANOSYL]-THYMINE
SpectraBase Compound ID GMMEc3tPVT7
InChI InChI=1S/C20H24N2O10S2/c1-13-9-22-18-15(31-19(22)21-17(13)23)16(28-10-14-7-5-4-6-8-14)20(32-18,11-29-33(2,24)25)12-30-34(3,26)27/h4-9,15-16,18H,10-12H2,1-3H3/t15-,16+,18+/m1/s1
InChIKey UVBLRJSYIDGHFM-RYRKJORJSA-N
Mol Weight 516.54 g/mol
Molecular Formula C20H24N2O10S2
Exact Mass 516.087237 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JxtXvec6bHG
Name 2,2'-ANHYDRO-1-[3-BENZYL-5-O-(METHYLSULFONYL)-4-C-(METHYLSULFONYLOXYMETHYL)-ALPHA-L-ERYTHRO-PENTOFURANOSYL]-THYMINE
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24N2O10S2
InChI InChI=1S/C20H24N2O10S2/c1-13-9-22-18-15(31-19(22)21-17(13)23)16(28-10-14-7-5-4-6-8-14)20(32-18,11-29-33(2,24)25)12-30-34(3,26)27/h4-9,15-16,18H,10-12H2,1-3H3/t15-,16+,18+/m1/s1
InChIKey UVBLRJSYIDGHFM-RYRKJORJSA-N
Literature Reference Author B.R.BABU,RAUNAK,N.E.POOPEIKO,M.JUHL,A.D.BOND,V.S.PARMAR,J.WE NGEL
Literature Reference Citation EUR.J.ORG.CHEM.,2297(2005)
Literature Reference DOI 10.1002/ejoc.200500023
Molecular Weight 516.538 g/mol
Sample ID 39313
Solvent DMSO-D6