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CYCLO-(3-METHYLSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-3'-O-DECANOYL-(2'-DEOXYURIDINYL)-PHOSPHATE;3-ME-CYCLO-SAL-3'-O-DEC-BVDUMP
SpectraBase Compound ID E0S43Gv6xna
InChI InChI=1S/2C29H38BrN2O9P/c2*1-3-4-5-6-7-8-9-13-26(33)40-23-16-25(32-17-21(14-15-30)28(34)31-29(32)35)39-24(23)19-38-42(36)37-18-22-12-10-11-20(2)27(22)41-42/h2*10-12,14-15,17,23-25H,3-9,13,16,18-19H2,1-2H3,(H,31,34,35)/b2*15-14+/t2*23-,24+,25+,42?/m11/s1
InChIKey RTBLUHGOUZSNEJ-SLAOFAQWSA-N
Mol Weight 1339.0 g/mol
Molecular Formula C58H76Br2N4O18P2
Exact Mass 1336.299662 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6GsEAryopec
Name CYCLO-(3-METHYLSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-3'-O-DECANOYL-(2'-DEOXYURIDINYL)-PHOSPHATE;3-ME-CYCLO-SAL-3'-O-DEC-BVDUMP
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H76Br2N4O18P2
InChI InChI=1S/2C29H38BrN2O9P/c2*1-3-4-5-6-7-8-9-13-26(33)40-23-16-25(32-17-21(14-15-30)28(34)31-29(32)35)39-24(23)19-38-42(36)37-18-22-12-10-11-20(2)27(22)41-42/h2*10-12,14-15,17,23-25H,3-9,13,16,18-19H2,1-2H3,(H,31,34,35)/b2*15-14+/t2*23-,24+,25+,42?/m11/s1
InChIKey RTBLUHGOUZSNEJ-SLAOFAQWSA-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 1339.013 g/mol
Sample ID 65648
Solvent CDCl3