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(Z)-4-[2-DIMETHYLPHOSPHONO-2-(6-CHLOROPURIN-9-YL)-ETHYLIDENE]-2,3-DIMETHOXY-DELTA(ALPHA,BETA)-BUTENOLIDE
SpectraBase Compound ID E1PvBZsDaPP
InChI InChI=1S/C15H16ClN4O7P/c1-23-11-8(27-15(21)12(11)24-2)5-9(28(22,25-3)26-4)20-7-19-10-13(16)17-6-18-14(10)20/h5-7,9H,1-4H3/b8-5-
InChIKey KMHTYHHUTHPWPP-YVMONPNESA-N
Mol Weight 430.74 g/mol
Molecular Formula C15H16ClN4O7P
Exact Mass 430.044514 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HGEfW3SegaF
Name (Z)-4-[2-DIMETHYLPHOSPHONO-2-(6-CHLOROPURIN-9-YL)-ETHYLIDENE]-2,3-DIMETHOXY-DELTA(ALPHA,BETA)-BUTENOLIDE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H16ClN4O7P
InChI InChI=1S/C15H16ClN4O7P/c1-23-11-8(27-15(21)12(11)24-2)5-9(28(22,25-3)26-4)20-7-19-10-13(16)17-6-18-14(10)20/h5-7,9H,1-4H3/b8-5-
InChIKey KMHTYHHUTHPWPP-YVMONPNESA-N
Literature Reference Author G.H.HAKIMELAHI,N.W.MEI,A.A.MOOSAVI-MOVAHEDI,H.DAVARI,S.HAKIM ELAHI,K.Y.KING,J.R.H
Literature Reference Citation J.MED.CHEM.,44,1749(2001)
Literature Reference DOI 10.1021/jm0004446
Molecular Weight 430.741 g/mol
Sample ID 44525
Solvent CDCl3