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6-ETHOXY-9-[(1'-BETA,2'-ALPHA,3'-ALPHA,4'-BETA)-4'-[ETHOXY-(HYDROXY)-PHOSPHORYLMETHOXY]-2',3'-ISOPROPYLIDENEDIOXYCYCLOPENTYL]-PURINE

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6-ETHOXY-9-[(1'-BETA,2'-ALPHA,3'-ALPHA,4'-BETA)-4'-[ETHOXY-(HYDROXY)-PHOSPHORYLMETHOXY]-2',3'-ISOPROPYLIDENEDIOXYCYCLOPENTYL]-PURINE
SpectraBase Compound ID B6SYAgAoMZk
InChI InChI=1S/C18H27N4O7P/c1-5-25-17-13-16(19-8-20-17)22(9-21-13)11-7-12(26-10-30(23,24)27-6-2)15-14(11)28-18(3,4)29-15/h8-9,11-12,14-15H,5-7,10H2,1-4H3,(H,23,24)
InChIKey ZHDQIGOYUUPFET-UHFFFAOYSA-N
Mol Weight 442.41 g/mol
Molecular Formula C18H27N4O7P
Exact Mass 442.161736 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 15BPtH837gZ
Name 6-ETHOXY-9-[(1'-BETA,2'-ALPHA,3'-ALPHA,4'-BETA)-4'-[ETHOXY-(HYDROXY)-PHOSPHORYLMETHOXY]-2',3'-ISOPROPYLIDENEDIOXYCYCLOPENTYL]-PURINE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H26N4O7P
InChI InChI=1S/C18H27N4O7P/c1-5-25-17-13-16(19-8-20-17)22(9-21-13)11-7-12(26-10-30(23,24)27-6-2)15-14(11)28-18(3,4)29-15/h8-9,11-12,14-15H,5-7,10H2,1-4H3,(H,23,24)
InChIKey ZHDQIGOYUUPFET-UHFFFAOYSA-N
Literature Reference Author J.M.L.HILLMAN,S.M.ROBERTS
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3601(1997)
Literature Reference DOI 10.1039/a704961g
Solvent CD3OD
Source File Reference UWRU9431