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CYCLO-(3-METHYLSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-(2'-DEOXY-3'-O-D-PROLINYLURIDINYL)-PHOSPHATE;3-ME-CYCLO-3'-O-D-PRO-BVDUMP
SpectraBase Compound ID 5YmKzyY7A9M
InChI InChI=1S/2C24H27BrN3O9P/c2*1-14-4-2-5-16-12-33-38(32,37-21(14)16)34-13-19-18(36-23(30)17-6-3-9-26-17)10-20(35-19)28-11-15(7-8-25)22(29)27-24(28)31/h2*2,4-5,7-8,11,17-20,26H,3,6,9-10,12-13H2,1H3,(H,27,29,31)/b2*8-7+/t2*17-,18-,19+,20+,38?/m11/s1
InChIKey ZHDDLOOVOBYCBD-CMUXNNDSSA-N
Mol Weight 1224.74 g/mol
Molecular Formula C48H54Br2N6O18P2
Exact Mass 1222.133659 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L4EIHmKIT4Z
Name CYCLO-(3-METHYLSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-(2'-DEOXY-3'-O-D-PROLINYLURIDINYL)-PHOSPHATE;3-ME-CYCLO-3'-O-D-PRO-BVDUMP
Compound Number 4M
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H54Br2N6O18P2
InChI InChI=1S/2C24H27BrN3O9P/c2*1-14-4-2-5-16-12-33-38(32,37-21(14)16)34-13-19-18(36-23(30)17-6-3-9-26-17)10-20(35-19)28-11-15(7-8-25)22(29)27-24(28)31/h2*2,4-5,7-8,11,17-20,26H,3,6,9-10,12-13H2,1H3,(H,27,29,31)/b2*8-7+/t2*17-,18-,19+,20+,38?/m11/s1
InChIKey ZHDDLOOVOBYCBD-CMUXNNDSSA-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 1224.742 g/mol
Sample ID 65662
Solvent DMSO-D6