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7-[5-O-(4-METHOXYTRITYL)-BETA-D-RIBOFURANOSYL]-2-[[(DIMETHYLAMINO)-METHYLIDENE]-AMINO]-3H-PYRROLO-[2,3-D]-PYRIMIDINE-4(7H)-ONE
SpectraBase Compound ID Lac957FgBZD
InChI InChI=1S/C34H35N5O6/c1-38(2)21-35-33-36-30-26(31(42)37-33)18-19-39(30)32-29(41)28(40)27(45-32)20-44-34(22-10-6-4-7-11-22,23-12-8-5-9-13-23)24-14-16-25(43-3)17-15-24/h4-19,21,27-29,32,40-41H,20H2,1-3H3,(H,36,37,42)/b35-21+/t27-,28-,29-,32-/m0/s1
InChIKey KWUWQWOSZCNOIN-SBGNLLRDSA-N
Mol Weight 609.7 g/mol
Molecular Formula C34H35N5O6
Exact Mass 609.258734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LQbAQynSDOP
Name 7-[5-O-(4-METHOXYTRITYL)-BETA-D-RIBOFURANOSYL]-2-[[(DIMETHYLAMINO)-METHYLIDENE]-AMINO]-3H-PYRROLO-[2,3-D]-PYRIMIDINE-4(7H)-ONE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H35N5O6
InChI InChI=1S/C34H35N5O6/c1-38(2)21-35-33-36-30-26(31(42)37-33)18-19-39(30)32-29(41)28(40)27(45-32)20-44-34(22-10-6-4-7-11-22,23-12-8-5-9-13-23)24-14-16-25(43-3)17-15-24/h4-19,21,27-29,32,40-41H,20H2,1-3H3,(H,36,37,42)/b35-21+/t27-,28-,29-,32-/m0/s1
InChIKey KWUWQWOSZCNOIN-SBGNLLRDSA-N
Literature Reference Author F.SEELA,K.MERSMANN
Literature Reference Citation HELV.CHIM.ACTA,76,1435(1993)
Literature Reference DOI 10.1002/hlca.19930760404
Molecular Weight 609.682 g/mol
Solvent DMSO
Source File Reference UWRK1349