2'-Deoxyinosine 5'-(Tetrahydrogen Triphosphate)

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Properties Simple | Detailed

Formula C10H15N4O13P3
IUPAC Name [hydroxy-[[(2r,3s,5r)-3-hydroxy-5-(6-oxo-3h-purine-1,7-diium-4-id-9-yl)tetrahydrofuran-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate
Molecular Mass 492.166 g·mol−1
Heat of Formation -3030.8 ± 16.7 kJ·mol−1
Dipole Moment 11.79 ± 1.08 D
Volume 460.08 Å 3
Surface Area 342.67 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -1.96 ± eV
Point Group Symmetry C1
Synonyms
  • 2'-deoxyinosine 5'-triphosphate
  • 2'-deoxyinosine triphosphate
  • 2'-deoxyinosine-5'-triphosphate
  • 2'-ditp
  • [(2r,3s,5r)-3-hydroxy-5-(6-keto-3h-purin-9-yl)tetrahydrofuran-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-(6-oxo-3h-purin-9-yl)-2-tetrahydrofuranyl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-(6-oxo-3h-purin-9-yl)oxolan-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-(6-oxo-3h-purin-9-yl)oxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-(6-oxo-3h-purin-9-yl)tetrahydrofuran-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • inosine 5'-(tetrahydrogen triphosphate), 2'-deoxy-
CAS Number(s)
  • 16595-02-1
  • 23155-05-7
  • 95648-77-4
InChIKey UFJPAQSLHAGEBL-RRKCRQDMSA-N
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