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7-(4-CHLOROPHENYL)-5-PHENYL-2-(BETA-D-GLUCOPYRANOSYLTHIO)-PYRIDO-[2,3-D]-PYRIMIDINE-4-ONE
SpectraBase Compound ID 26N1RryFT09
InChI InChI=1S/C25H22ClN3O6S/c26-14-8-6-13(7-9-14)16-10-15(12-4-2-1-3-5-12)18-22(27-16)28-25(29-23(18)34)36-24-21(33)20(32)19(31)17(11-30)35-24/h1-10,17,19-21,24,30-33H,11H2,(H,27,28,29,34)/t17-,19-,20+,21-,24+/m1/s1
InChIKey DWUVKIPFRXZJDM-MJALHYBGSA-N
Mol Weight 527.98 g/mol
Molecular Formula C25H22ClN3O6S
Exact Mass 527.091784 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J0rMZ1WEaCx
Name 7-(4-CHLOROPHENYL)-5-PHENYL-2-(BETA-D-GLUCOPYRANOSYLTHIO)-PYRIDO-[2,3-D]-PYRIMIDINE-4-ONE
Compound Number 15A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H22ClN3O6S
InChI InChI=1S/C25H22ClN3O6S/c26-14-8-6-13(7-9-14)16-10-15(12-4-2-1-3-5-12)18-22(27-16)28-25(29-23(18)34)36-24-21(33)20(32)19(31)17(11-30)35-24/h1-10,17,19-21,24,30-33H,11H2,(H,27,28,29,34)/t17-,19-,20+,21-,24+/m1/s1
InChIKey DWUVKIPFRXZJDM-MJALHYBGSA-N
Literature Reference Author M.M.BABATIN,M.M.SAID,H.N.HAFEZ,A.R.B.A.EL-GAZZAR
Literature Reference Citation INT.J.PH.SC.R.R.,4,25(2010)
Molecular Weight 527.979 g/mol
Solvent DMSO-D6
Source File Reference UWBT13480