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5'-O-PIVALOYLTHYMIDINE_3'-[2-METHOXYETHYL,2,2-BIS-(CYANO)-3-(4,4'-DIMETHOXYTRITYLOXY)-PROPYL]-PHOSPHATE;DIASTEREOMER_1
SpectraBase Compound ID EvhbgFE2fsi
InChI InChI=1S/C42H47N4O11P/c1-30-24-46(39(49)45-37(30)47)36-23-34(35(56-36)25-52-38(48)40(2,3)4)57-58(50,54-22-21-51-5)55-29-41(26-43,27-44)28-53-42(31-15-9-6-10-16-31,32-17-11-7-12-18-32)33-19-13-8-14-20-33/h6-20,24,34-36H,21-23,25,28-29H2,1-5H3,(H,45,47,49)/t34-,35+,36+,58?/m0/s1
InChIKey BPZRNXRSRLMTTN-HFEUJZEOSA-N
Mol Weight 814.8 g/mol
Molecular Formula C42H47N4O11P
Exact Mass 814.297895 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6jsWxAYRhMn
Name 5'-O-PIVALOYLTHYMIDINE_3'-[2-METHOXYETHYL,2,2-BIS-(CYANO)-3-(4,4'-DIMETHOXYTRITYLOXY)-PROPYL]-PHOSPHATE;DIASTEREOMER_1
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H47N4O11P
InChI InChI=1S/C42H47N4O11P/c1-30-24-46(39(49)45-37(30)47)36-23-34(35(56-36)25-52-38(48)40(2,3)4)57-58(50,54-22-21-51-5)55-29-41(26-43,27-44)28-53-42(31-15-9-6-10-16-31,32-17-11-7-12-18-32)33-19-13-8-14-20-33/h6-20,24,34-36H,21-23,25,28-29H2,1-5H3,(H,45,47,49)/t34-,35+,36+,58?/m0/s1
InChIKey BPZRNXRSRLMTTN-HFEUJZEOSA-N
Literature Reference Author M.ORA,E.MAEKI,P.POIJAERVI,K.NEUVONEN,M.OIVANEN,H.LOENNBERG
Literature Reference Citation J.CHEM.SOC.PERKIN-2,881(2001)
Literature Reference DOI 10.1039/b101754n
Solvent CDCl3
Source File Reference UWMZ20103