John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=38nBo2x0pUJ SpectraBase Spectrum ID=1kSiHaXfrOl

(accessed ).
5-[2-(ISOPRPYLOXYCARBONYLOXYMETHOXYCARBONYL)-ETHYL]-CYCLOSAL-D4T-MONOPHOSPHATE
SpectraBase Compound ID 38nBo2x0pUJ
InChI InChI=1S/2C25H29N2O12P/c2*1-15(2)37-25(31)34-14-33-22(28)9-5-17-4-7-20-18(10-17)12-35-40(32,39-20)36-13-19-6-8-21(38-19)27-11-16(3)23(29)26-24(27)30/h2*4,6-8,10-11,15,19,21H,5,9,12-14H2,1-3H3,(H,26,29,30)/t2*19-,21+,40?/m00/s1
InChIKey KJJBCHMJNFERCA-YTVACUHRSA-N
Mol Weight 1160.97 g/mol
Molecular Formula C50H58N4O24P2
Exact Mass 1160.291626 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1kSiHaXfrOl
Name 5-[2-(ISOPRPYLOXYCARBONYLOXYMETHOXYCARBONYL)-ETHYL]-CYCLOSAL-D4T-MONOPHOSPHATE
Compound Number 4C
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H58N4O24P2
InChI InChI=1S/2C25H29N2O12P/c2*1-15(2)37-25(31)34-14-33-22(28)9-5-17-4-7-20-18(10-17)12-35-40(32,39-20)36-13-19-6-8-21(38-19)27-11-16(3)23(29)26-24(27)30/h2*4,6-8,10-11,15,19,21H,5,9,12-14H2,1-3H3,(H,26,29,30)/t2*19-,21+,40?/m00/s1
InChIKey KJJBCHMJNFERCA-YTVACUHRSA-N
Literature Reference Author C.MEIER,C.DUCHO,H.JESSEN,D.VUKADINOVIC-TENTER,J.BALZARINI
Literature Reference Citation EUR.J.ORG.CHEM.,197(2006)
Molecular Weight 1160.970 g/mol
Sample ID 42810
Solvent DMSO-D6
SpectraBase Batch ID 3SnO93h2zbW