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CYCLO-(3-METHYLSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-(2'-DEOXY-3'-O-GLYCINYLURIDINYL)-PHOSPHATE;3-ME-CYCLO-SAL-3'-GLY-BVDUMP

View entire compound with spectra: 2 NMR

CYCLO-(3-METHYLSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-(2'-DEOXY-3'-O-GLYCINYLURIDINYL)-PHOSPHATE;3-ME-CYCLO-SAL-3'-GLY-BVDUMP
SpectraBase Compound ID HmcRKHFu63G
InChI InChI=1S/2C21H23BrN3O9P/c2*1-12-3-2-4-14-10-30-35(29,34-19(12)14)31-11-16-15(33-18(26)8-23)7-17(32-16)25-9-13(5-6-22)20(27)24-21(25)28/h2*2-6,9,15-17H,7-8,10-11,23H2,1H3,(H,24,27,28)/b2*6-5+/t2*15-,16+,17+,35?/m11/s1
InChIKey TVXAVSQSBGULHM-BLDHLQNWSA-N
Mol Weight 1144.61 g/mol
Molecular Formula C42H46Br2N6O18P2
Exact Mass 1142.071059 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3DV9rQ8dkzr
Name CYCLO-(3-METHYLSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-(2'-DEOXY-3'-O-GLYCINYLURIDINYL)-PHOSPHATE;3-ME-CYCLO-SAL-3'-GLY-BVDUMP
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H46Br2N6O18P2
InChI InChI=1S/2C21H23BrN3O9P/c2*1-12-3-2-4-14-10-30-35(29,34-19(12)14)31-11-16-15(33-18(26)8-23)7-17(32-16)25-9-13(5-6-22)20(27)24-21(25)28/h2*2-6,9,15-17H,7-8,10-11,23H2,1H3,(H,24,27,28)/b2*6-5+/t2*15-,16+,17+,35?/m11/s1
InChIKey TVXAVSQSBGULHM-BLDHLQNWSA-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
Molecular Weight 1144.612 g/mol
Sample ID 65650
Solvent DMSO-D6