1-[5-O-(Hydroxy{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Phosphoryl)-β-D-Ribofuranosyl]-1H-1,2,4-Triazole-3-Carboxamide

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Properties Simple | Detailed

Formula C8H15N4O14P3
IUPAC Name [[(2r,3s,4r,5r)-5-(3-carbamoyl-1,2,4-triazol-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate
Molecular Mass 484.144 g·mol−1
Heat of Formation -3237.4 ± 16.7 kJ·mol−1
Dipole Moment 5.80 ± 1.08 D
Volume 463.64 Å 3
Surface Area 353.82 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy -1.69 ± eV
Point Group Symmetry C1
Synonyms
  • 1-.beta.-d-ribofuranosyl-1,2,4-triazolo-3-carboxamide-5'-triphosphate
  • 1h-1,2,4-triazole-3-carboxamide, 1-(5-o-(hydroxy((hydroxy(phosphonooxy)phosphinyl)oxy)phosphinyl)-beta-d-ribofuranosyl)-
  • 1h-1,2,4-triazole-3-carboxamide, 1-[5-o-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]-b-d-ribofuranosyl]-
  • 1h-1,2,4-triazole-3-carboxamide, 1-[5-o-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]-beta-d-ribofuranosyl]-
  • [(2r,3s,4r,5r)-5-(3-aminocarbonyl-1,2,4-triazol-1-yl)-3,4-dihydroxy-oxolan-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2r,3s,4r,5r)-5-(3-carbamoyl-1,2,4-triazol-1-yl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
  • [(2r,3s,4r,5r)-5-(3-carbamoyl-1,2,4-triazol-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • ribavirin 5'-triphosphate
  • ribavirin-5'-triphosphate
  • ribavirin-tp
  • virazole 5'-triphosphate
CAS Number(s)
  • 63142-71-2
InChIKey MMJOCKKLRMRSEQ-AFCXAGJDSA-N
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