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9-[4-(DIPHOSPHORYLOXYPHOSPHONYLMETHOXY)-CYCLOPENT-2-ENYL]-ADENINE
SpectraBase Compound ID JJroOQoXumF
InChI InChI=1S/C11H16N5O10P3/c12-10-9-11(14-4-13-10)16(5-15-9)7-1-2-8(3-7)24-6-27(17,18)25-29(22,23)26-28(19,20)21/h1-2,4-5,7-8H,3,6H2,(H,17,18)(H,22,23)(H2,12,13,14)(H2,19,20,21)/t7-,8+/m0/s1
InChIKey VUGGRZMGKXPUEU-JGVFFNPUSA-N
Mol Weight 471.2 g/mol
Molecular Formula C11H16N5O10P3
Exact Mass 471.011003 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B394FyvzpPI
Name 9-[4-(DIPHOSPHORYLOXYPHOSPHONYLMETHOXY)-CYCLOPENT-2-ENYL]-ADENINE
Compound Number VIA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12N5O10P3
InChI InChI=1S/C11H16N5O10P3/c12-10-9-11(14-4-13-10)16(5-15-9)7-1-2-8(3-7)24-6-27(17,18)25-29(22,23)26-28(19,20)21/h1-2,4-5,7-8H,3,6H2,(H,17,18)(H,22,23)(H2,12,13,14)(H2,19,20,21)/t7-,8+/m0/s1
InChIKey VUGGRZMGKXPUEU-JGVFFNPUSA-N
Literature Reference Author A.L.KHANDAZHINSKAYA,E.A.SHIROKOVA,Y.S.SKOBLOV,L.S.VICTOROVA, L.Y.GORYUNOVA,R.S.BE
Literature Reference Citation J.MED.CHEM.,45,1284(2002)
Literature Reference DOI 10.1021/jm011011l
Solvent D2O
Source File Reference UWLU64473