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1-(R)-1,4-DIDEOXY-1-C-[1-[(ETHYL)-(URIDIN-5-YL)-PHOSPHONO]-PROPEN-3-YL]-1,4-IMINO-D-GALACTITOL
SpectraBase Compound ID DhbI7YV7VOu
InChI InChI=1S/2C20H32N3O12P/c2*1-2-33-36(32,7-3-4-10-15(27)17(29)14(21-10)11(25)8-24)34-9-12-16(28)18(30)19(35-12)23-6-5-13(26)22-20(23)31/h2*3,5-7,10-12,14-19,21,24-25,27-30H,2,4,8-9H2,1H3,(H,22,26,31)/b2*7-3+/t10-,11+,12+,14+,15+,16+,17+,18+,19+,36?;10-,11-,12+,14+,15+,16+,17+,18+,19+,36?/m11/s1
InChIKey AFMQCQNFUJPFTQ-UAXJEEDKSA-N
Mol Weight 1074.9 g/mol
Molecular Formula C40H64N6O24P2
Exact Mass 1074.344721 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2KSlrPALRll
Name 1-(R)-1,4-DIDEOXY-1-C-[1-[(ETHYL)-(URIDIN-5-YL)-PHOSPHONO]-PROPEN-3-YL]-1,4-IMINO-D-GALACTITOL
Compound Number 1 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H64N6O24P2
InChI InChI=1S/2C20H32N3O12P/c2*1-2-33-36(32,7-3-4-10-15(27)17(29)14(21-10)11(25)8-24)34-9-12-16(28)18(30)19(35-12)23-6-5-13(26)22-20(23)31/h2*3,5-7,10-12,14-19,21,24-25,27-30H,2,4,8-9H2,1H3,(H,22,26,31)/b2*7-3+/t10-,11+,12+,14+,15+,16+,17+,18+,19+,36?;10-,11-,12+,14+,15+,16+,17+,18+,19+,36?/m11/s1
InChIKey AFMQCQNFUJPFTQ-UAXJEEDKSA-N
Literature Reference Author V.LIAUTARD,V.DESVERGNES,O.R.MARTIN
Literature Reference Citation ORG.LETTERS,8,1299(2006)
Literature Reference DOI 10.1021/ol053078z
Solvent CD3OD
Source File Reference UWSI40041