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5'-O-(tert-Butyldiphenylsilyl)-2',3'-di-O-(p-toluenesulfonyl)adenosine
SpectraBase Compound ID 5meJXw5ewMF
InChI InChI=1S/C40H43N5O8S2Si/c1-27-16-20-29(21-17-27)54(46,47)52-35-33(24-50-56(40(3,4)5,31-12-8-6-9-13-31)32-14-10-7-11-15-32)51-39(45-26-44-34-37(41)42-25-43-38(34)45)36(35)53-55(48,49)30-22-18-28(2)19-23-30/h6-23,25-26,33,35-36,39H,24H2,1-5H3,(H2,41,42,43)/t33-,35-,36-,39-/m1/s1
InChIKey SFLGDRVKDPSFLN-ZENBVRMOSA-N
Mol Weight 814.0 g/mol
Molecular Formula C40H43N5O8S2Si
Exact Mass 813.232232 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8unl153lR4Y
Name 5'-O-(tert-Butyldiphenylsilyl)-2',3'-di-O-(p-toluenesulfonyl)adenosine
Alternate Name(s) (2R,3R,4R,5R)-2-(6-amino-9H-purin-9-yl)-5-{[(tert-butyldiphenylsilyl)oxy]methyl}-4-{[(4-methylbenzene)sulfonyl]oxy}oxolan-3-yl 4-methylbenzene-1-sulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H43N5O8S2Si
InChI InChI=1S/C40H43N5O8S2Si/c1-27-16-20-29(21-17-27)54(46,47)52-35-33(24-50-56(40(3,4)5,31-12-8-6-9-13-31)32-14-10-7-11-15-32)51-39(45-26-44-34-37(41)42-25-43-38(34)45)36(35)53-55(48,49)30-22-18-28(2)19-23-30/h6-23,25-26,33,35-36,39H,24H2,1-5H3,(H2,41,42,43)/t33-,35-,36-,39-/m1/s1
InChIKey SFLGDRVKDPSFLN-ZENBVRMOSA-N
Molecular Weight 814.016 g/mol
SMILES Nc1c2c([n]([C@]3([C@@]([C@](OS(c4ccc(cc4)C)(=O)=O)([C@](O3)(CO[Si](C(C)(C)C)(c3ccccc3)c3ccccc3)[H])[H])(OS(c3ccc(cc3)C)(=O)=O)[H])[H])cn2)ncn1
SPLASH splash10-052b-0900500700-3ea6a01531672d3f1278
Source of Spectrum F-53-6298-8
Wiley ID 802149