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N-[METHYL-(2,3,4-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYLOXYCARBONYL)-URONATE)-(5-FLUORO-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-1-YL)-METHYLAMINE

View entire compound with spectra: 1 NMR

N-[METHYL-(2,3,4-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYLOXYCARBONYL)-URONATE)-(5-FLUORO-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-1-YL)-METHYLAMINE
SpectraBase Compound ID 3BUSmqkz4Ek
InChI InChI=1S/C19H22FN3O13/c1-7(24)32-11-12(33-8(2)25)14(34-9(3)26)17(35-13(11)16(28)31-4)36-19(30)21-6-23-5-10(20)15(27)22-18(23)29/h5,11-14,17H,6H2,1-4H3,(H,21,30)(H,22,27,29)/t11-,12-,13-,14+,17-/m1/s1
InChIKey SCFMWWSKEIFREQ-MNLSVMLLSA-N
Mol Weight 519.39 g/mol
Molecular Formula C19H22FN3O13
Exact Mass 519.113666 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ni2z2B3oWL
Name N-[METHYL-(2,3,4-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYLOXYCARBONYL)-URONATE)-(5-FLUORO-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-1-YL)-METHYLAMINE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H22FN3O13
InChI InChI=1S/C19H22FN3O13/c1-7(24)32-11-12(33-8(2)25)14(34-9(3)26)17(35-13(11)16(28)31-4)36-19(30)21-6-23-5-10(20)15(27)22-18(23)29/h5,11-14,17H,6H2,1-4H3,(H,21,30)(H,22,27,29)/t11-,12-,13-,14+,17-/m1/s1
InChIKey SCFMWWSKEIFREQ-MNLSVMLLSA-N
Literature Reference Author R.MADEC-LOUGERSTAY,J.C.FLORENT,C.MONNERET
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1369(1999)
Literature Reference DOI 10.1039/a808915i
Molecular Weight 519.394 g/mol
Solvent CDCl3
Source File Reference UWRU5677