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7-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRIPHENYL)-METHYL-BETA-D-ERYTHRO-PENTOFURANOSYL]-4-ISOBUTYRYLAMINO-7H-PYRAZOLO-[3,4-D]-[1,2,3]-TRIAZINE

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7-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRIPHENYL)-METHYL-BETA-D-ERYTHRO-PENTOFURANOSYL]-4-ISOBUTYRYLAMINO-7H-PYRAZOLO-[3,4-D]-[1,2,3]-TRIAZINE
SpectraBase Compound ID 7UHGtnI711h
InChI InChI=1S/C34H36N6O6/c1-21(2)33(42)36-31-27-19-35-40(32(27)38-39-37-31)30-18-28(41)29(46-30)20-45-34(22-8-6-5-7-9-22,23-10-14-25(43-3)15-11-23)24-12-16-26(44-4)17-13-24/h5-17,19,21,28-30,41H,18,20H2,1-4H3,(H,36,37,38,42)/t28-,29+,30+/m0/s1
InChIKey JCOWIFOSYXGEIZ-FRXPANAUSA-N
Mol Weight 624.7 g/mol
Molecular Formula C34H36N6O6
Exact Mass 624.269633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1p5tYYEuYR
Name 7-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRIPHENYL)-METHYL-BETA-D-ERYTHRO-PENTOFURANOSYL]-4-ISOBUTYRYLAMINO-7H-PYRAZOLO-[3,4-D]-[1,2,3]-TRIAZINE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H36N6O6
InChI InChI=1S/C34H36N6O6/c1-21(2)33(42)36-31-27-19-35-40(32(27)38-39-37-31)30-18-28(41)29(46-30)20-45-34(22-8-6-5-7-9-22,23-10-14-25(43-3)15-11-23)24-12-16-26(44-4)17-13-24/h5-17,19,21,28-30,41H,18,20H2,1-4H3,(H,36,37,38,42)/t28-,29+,30+/m0/s1
InChIKey JCOWIFOSYXGEIZ-FRXPANAUSA-N
Literature Reference Author F.SEELA,M.LINDNER,V.GLACON,W.LIN
Literature Reference Citation J.ORG.CHEM.,69,4695(2004)
Literature Reference DOI 10.1021/jo040150i
Molecular Weight 624.696 g/mol
Solvent DMSO-D6
Source File Reference UWVN22018