(4R)-1-(2-Deoxy-5-O-Phosphono-β-D-Erythro-Pentofuranosyl)-4-Hydroxy-3,4-Dihydro-2(1H)-Pyrimidinone

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Properties Simple | Detailed

Formula C9H15N2O8P
IUPAC Name [(2r,3s,5r)-3-hydroxy-5-[(6r)-6-hydroxy-2-oxo-1,6-dihydropyrimidin-3-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 310.198 g·mol−1
Heat of Formation -1725.0 ± 16.7 kJ·mol−1
Dipole Moment 3.67 ± 1.08 D
Volume 318.41 Å 3
Surface Area 274.18 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
Synonyms
  • ((2r,3s,5r)-3-hydroxy-5-(4-hydroxy-2-oxo-3,4-dihydropyrimidin-1(2h)-yl)-tetrahydrofuran-2-yl)methyl dihydrogen phosphate
  • 3,4-dihydro-2'-deoxyuridine-5'-monophosphate
  • [(2r,3s,5r)-3-hydroxy-5-[(4r)-4-hydroxy-2-keto-3,4-dihydropyrimidin-1-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-[(4r)-4-hydroxy-2-oxo-3,4-dihydropyrimidin-1-yl]-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-[(4r)-4-hydroxy-2-oxo-3,4-dihydropyrimidin-1-yl]oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-[(4r)-4-hydroxy-2-oxo-3,4-dihydropyrimidin-1-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • ddn
InChIKey ILSIYJVILUIVPM-LXGUWJNJSA-N
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