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7-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRIPHENYLMETHYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-N6-[(DIMETHYLAMINO)-METHYLIDENE]-ADENINE
SpectraBase Compound ID xRjjqDgAcp
InChI InChI=1S/C34H36N6O5/c1-39(2)21-37-32-31-33(36-20-35-32)38-22-40(31)30-18-28(41)29(45-30)19-44-34(23-8-6-5-7-9-23,24-10-14-26(42-3)15-11-24)25-12-16-27(43-4)17-13-25/h5-17,20-22,28-30,41H,18-19H2,1-4H3/b37-21+/t28-,29+,30+/m0/s1
InChIKey RTTDXRXGPZKKLU-ZNWPDXNHSA-N
Mol Weight 608.7 g/mol
Molecular Formula C34H36N6O5
Exact Mass 608.274718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2fCkvmLOffS
Name 7-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRIPHENYLMETHYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-N6-[(DIMETHYLAMINO)-METHYLIDENE]-ADENINE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H36N6O5
InChI InChI=1S/C34H36N6O5/c1-39(2)21-37-32-31-33(36-20-35-32)38-22-40(31)30-18-28(41)29(45-30)19-44-34(23-8-6-5-7-9-23,24-10-14-26(42-3)15-11-24)25-12-16-27(43-4)17-13-25/h5-17,20-22,28-30,41H,18-19H2,1-4H3/b37-21+/t28-,29+,30+/m0/s1
InChIKey RTTDXRXGPZKKLU-ZNWPDXNHSA-N
Literature Reference Author F.SEELA,H.WINTER
Literature Reference Citation HELV.CHIM.ACTA,77,597(1994)
Literature Reference DOI 10.1002/hlca.19940770223
Molecular Weight 608.697 g/mol
Solvent DMSO-D6
Source File Reference UWVP4009