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#11;C3-[2'-DEOXY-5'-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-6-([(DIMETHYLAMINO)-METHYLIDENE]-AMINO)-3H-IMIDAZO-[4,5-C]-PYRIDIN-4(5H)-ONE
SpectraBase Compound ID 8Tg3Ml8dj2Z
InChI InChI=1S/C35H38N5O8P.C6H15N/c1-39(2)21-37-31-18-28-33(34(41)38-31)40(22-36-28)32-19-29(48-49(42)43)30(47-32)20-46-35(23-8-6-5-7-9-23,24-10-14-26(44-3)15-11-24)25-12-16-27(45-4)17-13-25;1-4-7(5-2)6-3/h5-18,21-22,29-30,32,49H,19-20H2,1-4H3,(H,38,41)(H,42,43);4-6H2,1-3H3/b37-21+;/t29-,30+,32+;/m0./s1
InChIKey RRRYFRJDAMSDPA-UQMXDSRASA-N
Mol Weight 788.9 g/mol
Molecular Formula C41H53N6O8P
Exact Mass 788.36625 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IdX2mSNd2Vy
Name #11;C3-[2'-DEOXY-5'-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-6-([(DIMETHYLAMINO)-METHYLIDENE]-AMINO)-3H-IMIDAZO-[4,5-C]-PYRIDIN-4(5H)-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H53N6O8P
InChI InChI=1S/C35H38N5O8P.C6H15N/c1-39(2)21-37-31-18-28-33(34(41)38-31)40(22-36-28)32-19-29(48-49(42)43)30(47-32)20-46-35(23-8-6-5-7-9-23,24-10-14-26(44-3)15-11-24)25-12-16-27(45-4)17-13-25;1-4-7(5-2)6-3/h5-18,21-22,29-30,32,49H,19-20H2,1-4H3,(H,38,41)(H,42,43);4-6H2,1-3H3/b37-21+;/t29-,30+,32+;/m0./s1
InChIKey RRRYFRJDAMSDPA-UQMXDSRASA-N
Literature Reference Author F.SEELA,S.LAMPE
Literature Reference Citation HELV.CHIM.ACTA,74,1790(1991)
Literature Reference DOI 10.1002/hlca.19910740821
Molecular Weight 788.881 g/mol
Solvent DMSO-D6
Source File Reference UWCS21283