7-Methyl-7,8-Dihydroguanosine 5'-(Tetrahydrogen Triphosphate)

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Properties Simple | Detailed

Formula C11H20N5O14P3
IUPAC Name [[(2r,3s,4r,5r)-5-(2-amino-7-methyl-6-oxo-3,8-dihydropurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate
Molecular Mass 539.223 g·mol−1
Heat of Formation -3331.3 ± 16.7 kJ·mol−1
Dipole Moment 6.82 ± 1.08 D
Volume 507.78 Å 3
Surface Area 409.73 Å 2
HOMO Energy -8.16 ± 0.55 eV
LUMO Energy -1.73 ± eV
Point Group Symmetry C1
Synonyms
  • 7n-methyl-8-hydroguanosine-5'-triphosphate
  • [(2r,3s,4r,5r)-5-(2-amino-6-keto-7-methyl-3,8-dihydropurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2r,3s,4r,5r)-5-(2-amino-7-methyl-6-oxo-3,8-dihydropurin-9-yl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
  • [(2r,3s,4r,5r)-5-(2-amino-7-methyl-6-oxo-3,8-dihydropurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2r,3s,4r,5r)-5-(2-amino-7-methyl-6-oxo-3,8-dihydropurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
InChIKey BUJQMJUTTBGELS-KQYNXXCUSA-N
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