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9-[2'-DEOXY-5'-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-6-[(DIMETHYLAMINO)-METHYLIDENE]-9H-ISOGUANINE
SpectraBase Compound ID DzCyoJLOxqg
InChI InChI=1S/C34H36N6O6/c1-39(2)20-36-31-30-32(38-33(42)37-31)40(21-35-30)29-18-27(41)28(46-29)19-45-34(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/h5-17,20-21,27-29,41H,18-19H2,1-4H3,(H,37,38,42)/b36-20+/t27-,28+,29+/m0/s1
InChIKey OEACHSNKOZJMQL-FTBOMTEUSA-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 6Fy9zLzHFXG
Name 9-[2'-DEOXY-5'-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-6-[(DIMETHYLAMINO)-METHYLIDENE]-9H-ISOGUANINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H36N6O6
InChI InChI=1S/C34H36N6O6/c1-39(2)20-36-31-30-32(38-33(42)37-31)40(21-35-30)29-18-27(41)28(46-29)19-45-34(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/h5-17,20-21,27-29,41H,18-19H2,1-4H3,(H,37,38,42)/b36-20+/t27-,28+,29+/m0/s1
InChIKey OEACHSNKOZJMQL-FTBOMTEUSA-N
Literature Reference Author F.SEELA,R.MERTENS,Z.KAZIMIERCZUK
Literature Reference Citation HELV.CHIM.ACTA,75,2298(1992)
Literature Reference DOI 10.1002/hlca.19920750716
Molecular Weight 624.696 g/mol
Solvent DMSO-D6
Source File Reference UWCS7967