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5-HEXYNYLURIDINE_MONOPHOSPHATE

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5-HEXYNYLURIDINE_MONOPHOSPHATE
SpectraBase Compound ID 7yGz5LgSesC
InChI InChI=1S/C15H21N2O9P.N/c1-2-3-4-5-6-9-7-17(15(21)16-13(9)20)14-12(19)11(18)10(26-14)8-25-27(22,23)24;/h7,10-12,14,18-19H,2-4,8H2,1H3,(H,16,20,21)(H2,22,23,24);/q;+1/p-1/t10-,11-,12-,14-;/m1./s1
InChIKey XKIGVWAEUKABSS-XSCHNBKYSA-M
Mol Weight 417.31 g/mol
Molecular Formula C15H20N3O9P
Exact Mass 417.093716 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 90IuV8Phcpk
Name 5-HEXYNYLURIDINE_MONOPHOSPHATE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H19N3O9P
InChI InChI=1S/C15H21N2O9P.N/c1-2-3-4-5-6-9-7-17(15(21)16-13(9)20)14-12(19)11(18)10(26-14)8-25-27(22,23)24;/h7,10-12,14,18-19H,2-4,8H2,1H3,(H,16,20,21)(H2,22,23,24);/q;+1/p-1/t10-,11-,12-,14-;/m1./s1
InChIKey XKIGVWAEUKABSS-XSCHNBKYSA-M
Literature Reference Author E.CALLERI,S.CERUTI,G.CRISTALLI,C.MARTINI,C.TEMPORINI,C.PARRA VICINI,R.VOLPINI,S.D
Literature Reference Citation J.MED.CHEM.,53,3489(2010)
Literature Reference DOI 10.1021/jm901691y
Solvent D2O
Source File Reference UWMZ46020