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7-[5-O-(4-METHOXYTRITYL)-BETA-D-RIBOFURANOSYL]-2-[(2-METHYLPROPANOYL)-AMINO]-3H-PYRROLO-[2,3-D]-PYRIMIDIN-4(7H)-ONE
SpectraBase Compound ID LQ9YxEfqgI7
InChI InChI=1S/C35H36N4O7/c1-21(2)31(42)37-34-36-30-26(32(43)38-34)18-19-39(30)33-29(41)28(40)27(46-33)20-45-35(22-10-6-4-7-11-22,23-12-8-5-9-13-23)24-14-16-25(44-3)17-15-24/h4-19,21,27-29,33,40-41H,20H2,1-3H3,(H2,36,37,38,42,43)/t27-,28-,29-,33-/m0/s1
InChIKey FNVGEJTZZULAEI-UODPJZIASA-N
Mol Weight 624.7 g/mol
Molecular Formula C35H36N4O7
Exact Mass 624.2584 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HHowBmjkUn8
Name 7-[5-O-(4-METHOXYTRITYL)-BETA-D-RIBOFURANOSYL]-2-[(2-METHYLPROPANOYL)-AMINO]-3H-PYRROLO-[2,3-D]-PYRIMIDIN-4(7H)-ONE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H36N4O7
InChI InChI=1S/C35H36N4O7/c1-21(2)31(42)37-34-36-30-26(32(43)38-34)18-19-39(30)33-29(41)28(40)27(46-33)20-45-35(22-10-6-4-7-11-22,23-12-8-5-9-13-23)24-14-16-25(44-3)17-15-24/h4-19,21,27-29,33,40-41H,20H2,1-3H3,(H2,36,37,38,42,43)/t27-,28-,29-,33-/m0/s1
InChIKey FNVGEJTZZULAEI-UODPJZIASA-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 624.693 g/mol
Solvent DMSO
Source File Reference UWRK1348