2'-Deoxy-N-Hydroxyadenosine 5'-(Tetrahydrogen Triphosphate)

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Properties Simple | Detailed

Formula C10H16N5O13P3
IUPAC Name [(2r,3s,5r)-3-hydroxy-5-[6-(hydroxyamino)purine-1,3,7-triium-9-yl]tetrahydrofuran-2-yl]methyl [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate
Molecular Mass 507.181 g·mol−1
Heat of Formation -2948.4 ± 16.7 kJ·mol−1
Dipole Moment 6.31 ± 1.08 D
Volume 466.42 Å 3
Surface Area 359.91 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy -1.27 ± eV
Point Group Symmetry C1
Synonyms
  • 6-n-hydroxylaminopurine deoxynucleoside triphosphate
  • [(2r,3s,5r)-3-hydroxy-5-[6-(hydroxyamino)-9-purinyl]-2-tetrahydrofuranyl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-[6-(hydroxyamino)purin-9-yl]oxolan-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-[6-(hydroxyamino)purin-9-yl]oxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-[6-(hydroxyamino)purin-9-yl]tetrahydrofuran-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • dhaptp
  • inosine 5'-(tetrahydrogen triphosphate), 2'-deoxy-, 6-oxime
CAS Number(s)
  • 101212-53-7
InChIKey ZARICQQUEGTEEV-RRKCRQDMSA-N
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