Triphosphoric Acid, Mono[[(2S,5R)-5-(3,4-Dihydro-5-Methyl-2,4-Dioxo-1(2H)-Pyrimidinyl)Tetrahydro-2-Furanyl]Methyl] Ester

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Properties Simple | Detailed

Formula C10H17N2O13P3++
IUPAC Name [hydroxy-[[(2s,5r)-5-(5-methyl-2,4-dioxo-pyrimidin-1-ium-5-id-1-yl)tetrahydrofuran-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate
Molecular Mass 466.169 g·mol−1
Heat of Formation -3324.1 ± 16.7 kJ·mol−1
Dipole Moment 6.84 ± 1.08 D
Volume 437.93 Å 3
Surface Area 337.99 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy -1.40 ± eV
Point Group Symmetry C1
Synonyms
  • (hydroxy-phosphonooxy-phosphoryl) [(2s,5r)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)oxolan-2-yl]methyl hydrogen phosphate
  • (hydroxy-phosphonooxy-phosphoryl) [(2s,5r)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl hydrogen phosphate
  • (hydroxy-phosphonooxyphosphoryl) [(2s,5r)-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-tetrahydrofuranyl]methyl hydrogen phosphate
  • (hydroxy-phosphonooxyphosphoryl) [(2s,5r)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl hydrogen phosphate
  • 2',3'-dideoxy-thymidine-5'-triphosphate
  • 2',3'-dideoxythymidine 5'-triphosphate
  • 2',3'-dideoxythymidine triphosphate
  • 2',3'-dideoxythymidine-5'- triphosphate
  • 23t
  • [(2s,5r)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • d3t
  • ddt-tp
  • ddttp
  • dideoxy-ttp
  • thymidine 5'-(tetrahydrogen triphosphate), 3'-deoxy-
InChIKey URGJWIFLBWJRMF-JGVFFNPUSA-N
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