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#11;[1-[2',5'-BIS-O-(TERT.-BUTYLDIMETHYLSILYL)-BETA-D-RIBOFURANOSYL]-3-N-(METHYL)-THYMINE]-3'-SPIRO-5''-(4''-AMINO-3''-IODO-1'',2''-OXATHIOLE-2'',2''-DIOXIDE)

View entire compound with spectra: 1 NMR

#11;[1-[2',5'-BIS-O-(TERT.-BUTYLDIMETHYLSILYL)-BETA-D-RIBOFURANOSYL]-3-N-(METHYL)-THYMINE]-3'-SPIRO-5''-(4''-AMINO-3''-IODO-1'',2''-OXATHIOLE-2'',2''-DIOXIDE)
SpectraBase Compound ID GkNwGXxfida
InChI InChI=1S/C25H44IN3O8SSi2/c1-15-13-29(22(31)28(8)20(15)30)21-18(36-40(11,12)24(5,6)7)25(17(27)19(26)38(32,33)37-25)16(35-21)14-34-39(9,10)23(2,3)4/h13,16,18,21H,14,27H2,1-12H3/t16-,18+,21-,25+/m0/s1
InChIKey BIRHRYKGIRQHAT-PRSJCYMESA-N
Mol Weight 729.8 g/mol
Molecular Formula C25H44IN3O8SSi2
Exact Mass 729.143235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Qj5lrPfYxQ
Name #11;[1-[2',5'-BIS-O-(TERT.-BUTYLDIMETHYLSILYL)-BETA-D-RIBOFURANOSYL]-3-N-(METHYL)-THYMINE]-3'-SPIRO-5''-(4''-AMINO-3''-IODO-1'',2''-OXATHIOLE-2'',2''-DIOXIDE)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H44IN3O8SSi2
InChI InChI=1S/C25H44IN3O8SSi2/c1-15-13-29(22(31)28(8)20(15)30)21-18(36-40(11,12)24(5,6)7)25(17(27)19(26)38(32,33)37-25)16(35-21)14-34-39(9,10)23(2,3)4/h13,16,18,21H,14,27H2,1-12H3/t16-,18+,21-,25+/m0/s1
InChIKey BIRHRYKGIRQHAT-PRSJCYMESA-N
Literature Reference Author E.LOBATON,F.RODRIGUEZ-BARRIOS,F.GAGO,M.J.PEREZ-PEREZ,E.D.CLE RCQ,J.BALZARINI,M.J.
Literature Reference Citation J.MED.CHEM.,45,3934(2002)
Literature Reference DOI 10.1021/jm020820h
Molecular Weight 729.775 g/mol
Sample ID 64448
Solvent ACETONE-D6