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1-O-[(4-METHOXYPHENYL)-DIPHENYLMETHYL]-2,2-BIS-[(THYMIN-1-YL)-METHYL]-3-O-(P-BETA-CYANOETHYL-N,N-DIISOPROPYLAMINOPHOSPHINYL)-1,3-PROPANEDIOL
SpectraBase Compound ID 1oBki9VukQf
InChI InChI=1S/C44H53N6O8P/c1-31(2)50(32(3)4)59(57-24-14-23-45)58-30-43(27-48-25-33(5)39(51)46-41(48)53,28-49-26-34(6)40(52)47-42(49)54)29-56-44(35-15-10-8-11-16-35,36-17-12-9-13-18-36)37-19-21-38(55-7)22-20-37/h8-13,15-22,25-26,31-32H,14,24,27-30H2,1-7H3,(H,46,51,53)(H,47,52,54)
InChIKey LPZPYHZKTVHMDK-UHFFFAOYSA-N
Mol Weight 824.9 g/mol
Molecular Formula C44H53N6O8P
Exact Mass 824.36625 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FZKtqo2QcOK
Name 1-O-[(4-METHOXYPHENYL)-DIPHENYLMETHYL]-2,2-BIS-[(THYMIN-1-YL)-METHYL]-3-O-(P-BETA-CYANOETHYL-N,N-DIISOPROPYLAMINOPHOSPHINYL)-1,3-PROPANEDIOL
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H53N6O8P
InChI InChI=1S/C44H53N6O8P/c1-31(2)50(32(3)4)59(57-24-14-23-45)58-30-43(27-48-25-33(5)39(51)46-41(48)53,28-49-26-34(6)40(52)47-42(49)54)29-56-44(35-15-10-8-11-16-35,36-17-12-9-13-18-36)37-19-21-38(55-7)22-20-37/h8-13,15-22,25-26,31-32H,14,24,27-30H2,1-7H3,(H,46,51,53)(H,47,52,54)
InChIKey LPZPYHZKTVHMDK-UHFFFAOYSA-N
Literature Reference Author T.WU,M.FROEYEN,G.SCHEPERS,K.MULLENS,J.ROZENSKI,R.BUSSON,A.V. AERSCHOT,P.HERDEWIJN
Literature Reference Citation ORG.LETTERS,6,51(2004)
Literature Reference DOI 10.1021/ol0360647
Solvent Unknown
Source File Reference UWSI34951