5'-5,6-Dihydrouridylic Acid

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Properties Simple | Detailed

Formula C9H15N2O9P
IUPAC Name [(2r,3s,4r,5r)-5-(2,4-dioxohexahydropyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 326.197 g·mol−1
Heat of Formation -1953.0 ± 16.7 kJ·mol−1
Dipole Moment 5.41 ± 1.08 D
Volume 328.48 Å 3
Surface Area 291.59 Å 2
HOMO Energy -10.04 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
Synonyms
  • 2,4-dioxotetrahydropyrimidine d-ribonucleotide
  • [(2r,3s,4r,5r)-5-(2,4-diketohexahydropyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(2,4-dioxo-1,3-diazinan-1-yl)-3,4-dihydroxy-oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(2,4-dioxo-1-hexahydropyrimidinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(2,4-dioxohexahydropyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
InChIKey NBWDKGJHOHJBRJ-XVFCMESISA-N
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