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N(2)-ISOBUTYRYL-7-(2'-BENZOYL-3'-BENZOYLOXYMETHYL-6'-TERT.-BUTYLDIPHENYLSILYL-3',5'-DIDEOXY-BETA-D-ALLO-FURANOSYL)-GUANINE
SpectraBase Compound ID LLYywYRuiv2
InChI InChI=1S/C46H49N5O8Si/c1-30(2)40(52)49-45-48-39-37(41(53)50-45)51(29-47-39)42-38(59-44(55)32-20-12-7-13-21-32)35(28-56-43(54)31-18-10-6-11-19-31)36(58-42)26-27-57-60(46(3,4)5,33-22-14-8-15-23-33)34-24-16-9-17-25-34/h6-25,29-30,35-36,38,42H,26-28H2,1-5H3,(H2,48,49,50,52,53)/t35-,36-,38-,42-/m0/s1
InChIKey NKZKDJQDAPZNDE-GFRCEIONSA-N
Mol Weight 828.0 g/mol
Molecular Formula C46H49N5O8Si
Exact Mass 827.33504 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ge24FSKQYGu
Name N(2)-ISOBUTYRYL-7-(2'-BENZOYL-3'-BENZOYLOXYMETHYL-6'-TERT.-BUTYLDIPHENYLSILYL-3',5'-DIDEOXY-BETA-D-ALLO-FURANOSYL)-GUANINE
Compound Number 10A,N(7)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H49N5O8Si
InChI InChI=1S/C46H49N5O8Si/c1-30(2)40(52)49-45-48-39-37(41(53)50-45)51(29-47-39)42-38(59-44(55)32-20-12-7-13-21-32)35(28-56-43(54)31-18-10-6-11-19-31)36(58-42)26-27-57-60(46(3,4)5,33-22-14-8-15-23-33)34-24-16-9-17-25-34/h6-25,29-30,35-36,38,42H,26-28H2,1-5H3,(H2,48,49,50,52,53)/t35-,36-,38-,42-/m0/s1
InChIKey NKZKDJQDAPZNDE-GFRCEIONSA-N
Literature Reference Author C.RICHERT,A.L.ROUGHTON,S.A.BENNER
Literature Reference Citation J.AM.CHEM.SOC.,118,4518(1996)
Literature Reference DOI 10.1021/ja952322m
Molecular Weight 828.009 g/mol
Sample ID 57081
Solvent CDCl3