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CYCLO-(3-METHYLSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-(2'-DEOXY-3'-O-L-VALYNYLURIDINYL)-PHOSPHATE;3-ME-CYCLO-3'-O-L-VAL-BVDUMP
SpectraBase Compound ID K1WFkbYFWnk
InChI InChI=1S/2C24H29BrN3O9P/c2*1-13(2)20(26)23(30)36-17-9-19(28-10-15(7-8-25)22(29)27-24(28)31)35-18(17)12-34-38(32)33-11-16-6-4-5-14(3)21(16)37-38/h2*4-8,10,13,17-20H,9,11-12,26H2,1-3H3,(H,27,29,31)/b2*8-7+/t2*17-,18+,19+,20+,38?/m11/s1
InChIKey MUEUCDJMOSSSRB-NRLYXIPQSA-N
Mol Weight 1228.77 g/mol
Molecular Formula C48H58Br2N6O18P2
Exact Mass 1226.164959 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BZFDVLCNHps
Name CYCLO-(3-METHYLSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-(2'-DEOXY-3'-O-L-VALYNYLURIDINYL)-PHOSPHATE;3-ME-CYCLO-3'-O-L-VAL-BVDUMP
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H58Br2N6O18P2
InChI InChI=1S/2C24H29BrN3O9P/c2*1-13(2)20(26)23(30)36-17-9-19(28-10-15(7-8-25)22(29)27-24(28)31)35-18(17)12-34-38(32)33-11-16-6-4-5-14(3)21(16)37-38/h2*4-8,10,13,17-20H,9,11-12,26H2,1-3H3,(H,27,29,31)/b2*8-7+/t2*17-,18+,19+,20+,38?/m11/s1
InChIKey MUEUCDJMOSSSRB-NRLYXIPQSA-N
Literature Reference Author C.MEIER,A.LOMP,A.MEERBACH,P.WUTZLER
Literature Reference Citation J.MED.CHEM.,45,5157(2002)
Literature Reference DOI 10.1021/jm0209275
Solvent DMSO-D6
Source File Reference UWLU65653