2'-Deoxy-5-Isopropyluridine 5'-(Tetrahydrogen Triphosphate)

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Properties Simple | Detailed

Formula C12H21N2O14P3
IUPAC Name [hydroxy-[[(2r,3s,5r)-3-hydroxy-5-(5-isopropyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate
Molecular Mass 510.221 g·mol−1
Heat of Formation -3537.1 ± 16.7 kJ·mol−1
Dipole Moment 7.16 ± 1.08 D
Volume 507.62 Å 3
Surface Area 380.85 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy -2.02 ± eV
Point Group Symmetry C1
Synonyms
  • 5-ipdutp
  • 5-isopropyl-2'-deoxyuridine triphosphate
  • [(2r,3s,5r)-3-hydroxy-5-(5-isopropyl-2,4-diketo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-(5-isopropyl-2,4-dioxo-1-pyrimidinyl)-2-tetrahydrofuranyl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-(5-isopropyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2r,3s,5r)-5-(2,4-dioxo-5-propan-2-yl-pyrimidin-1-yl)-3-hydroxy-oxolan-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2r,3s,5r)-5-(2,4-dioxo-5-propan-2-ylpyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
  • uridine 5'-(tetrahydrogen triphosphate), 2'-deoxy-5-(1-methylethyl)-
CAS Number(s)
  • 64374-79-4
InChIKey VNFNFVMSTRVUTH-IVZWLZJFSA-N
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