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9-[1',3'-O-ANHYDRO-6'-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-PSICOFURANOSYL]-N-(6)-(PHENOXYACETYL)-ADENINE
SpectraBase Compound ID 5YaDZ9JDpV5
InChI InChI=1S/C40H37N5O8/c1-48-29-17-13-27(14-18-29)40(26-9-5-3-6-10-26,28-15-19-30(49-2)20-16-28)52-21-32-35(47)36-39(53-32,23-51-36)45-25-43-34-37(41-24-42-38(34)45)44-33(46)22-50-31-11-7-4-8-12-31/h3-20,24-25,32,35-36,47H,21-23H2,1-2H3,(H,41,42,44,46)/t32-,35-,36-,39-/m1/s1
InChIKey ZMVOITWQPQFYRY-FCOKYAGUSA-N
Mol Weight 715.8 g/mol
Molecular Formula C40H37N5O8
Exact Mass 715.264213 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JDLPxgL1JKL
Name 9-[1',3'-O-ANHYDRO-6'-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-PSICOFURANOSYL]-N-(6)-(PHENOXYACETYL)-ADENINE
Compound Number 22A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H37N5O8
InChI InChI=1S/C40H37N5O8/c1-48-29-17-13-27(14-18-29)40(26-9-5-3-6-10-26,28-15-19-30(49-2)20-16-28)52-21-32-35(47)36-39(53-32,23-51-36)45-25-43-34-37(41-24-42-38(34)45)44-33(46)22-50-31-11-7-4-8-12-31/h3-20,24-25,32,35-36,47H,21-23H2,1-2H3,(H,41,42,44,46)/t32-,35-,36-,39-/m1/s1
InChIKey ZMVOITWQPQFYRY-FCOKYAGUSA-N
Literature Reference Author P.I.PRADEEPKUMAR,P.CHERUKU,O.PLASHKEVYCH,P.ACHARYA,S.GOHIL,J .CHATTOPADHYAYA
Literature Reference Citation J.AM.CHEM.SOC.,126,11484(2004)
Literature Reference DOI 10.1021/ja048417i
Molecular Weight 715.762 g/mol
Solvent CDCl3
Source File Reference UWVN31643