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5-[2-(ACETOXYMETHOXYCARBONYL)-ETHYL]-CYCLOSAL-D4T-MONOPHOSPHATE

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5-[2-(ACETOXYMETHOXYCARBONYL)-ETHYL]-CYCLOSAL-D4T-MONOPHOSPHATE
SpectraBase Compound ID DVHLSo9Tk8i
InChI InChI=1S/2C23H25N2O11P/c2*1-14-10-25(23(29)24-22(14)28)20-7-5-18(35-20)12-34-37(30)33-11-17-9-16(3-6-19(17)36-37)4-8-21(27)32-13-31-15(2)26/h2*3,5-7,9-10,18,20H,4,8,11-13H2,1-2H3,(H,24,28,29)/t2*18-,20+,37?/m00/s1
InChIKey NQQQJKPPSGMORX-GGCRHQMYSA-N
Mol Weight 1072.86 g/mol
Molecular Formula C46H50N4O22P2
Exact Mass 1072.239193 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ohouX7UKXK
Name 5-[2-(ACETOXYMETHOXYCARBONYL)-ETHYL]-CYCLOSAL-D4T-MONOPHOSPHATE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H50N4O22P2
InChI InChI=1S/2C23H25N2O11P/c2*1-14-10-25(23(29)24-22(14)28)20-7-5-18(35-20)12-34-37(30)33-11-17-9-16(3-6-19(17)36-37)4-8-21(27)32-13-31-15(2)26/h2*3,5-7,9-10,18,20H,4,8,11-13H2,1-2H3,(H,24,28,29)/t2*18-,20+,37?/m00/s1
InChIKey NQQQJKPPSGMORX-GGCRHQMYSA-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 1072.864 g/mol
Sample ID 42808
Solvent DMSO-D6