John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=16FSB9lT1hr SpectraBase Spectrum ID=A70nV5hjZEw

(accessed ).
3,9-DIHYDRO-3-[(1,3-DIHYDROXY-2-PORPOXY)-METHYL]-6-[4-(ISOBUTYRYLOXY)-PHENYL]-9-OXO-5H-IMIDAZO-[1,2-A]-PURINE
SpectraBase Compound ID 16FSB9lT1hr
InChI InChI=1S/C21H23N5O6/c1-12(2)20(30)32-14-5-3-13(4-6-14)16-7-26-19(29)17-18(24-21(26)23-16)25(10-22-17)11-31-15(8-27)9-28/h3-7,10,12,15,27-28H,8-9,11H2,1-2H3,(H,23,24)
InChIKey SGOJZMPTJKOFIM-UHFFFAOYSA-N
Mol Weight 441.44 g/mol
Molecular Formula C21H23N5O6
Exact Mass 441.164834 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A70nV5hjZEw
Name 3,9-DIHYDRO-3-[(1,3-DIHYDROXY-2-PORPOXY)-METHYL]-6-[4-(ISOBUTYRYLOXY)-PHENYL]-9-OXO-5H-IMIDAZO-[1,2-A]-PURINE
Compound Number 18
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23N5O6
InChI InChI=1S/C21H23N5O6/c1-12(2)20(30)32-14-5-3-13(4-6-14)16-7-26-19(29)17-18(24-21(26)23-16)25(10-22-17)11-31-15(8-27)9-28/h3-7,10,12,15,27-28H,8-9,11H2,1-2H3,(H,23,24)
InChIKey SGOJZMPTJKOFIM-UHFFFAOYSA-N
Literature Reference Author T.GOSLINSKI,B.GOLANKIEWICZ,E.D.CLERCQ,J.BALAZARINI
Literature Reference Citation J.MED.CHEM.,45,5052(2002)
Literature Reference DOI 10.1021/jm020827z
Molecular Weight 441.444 g/mol
Sample ID 65165
Solvent DMSO-D6
SpectraBase Batch ID Cg7aqIAm1Aw