Bis{[(2R,3S,4R,5R)-5-(2-Amino-6-Oxo-3,6-Dihydro-9H-Purin-9-Yl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl} Dihydrogen Diphosphate

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Properties Simple | Detailed

Formula C20H22N10O15P2
IUPAC Name [[2-[(e)-c-formyl-n-(6-formyloxy-5-isocyano-2-λ1-azanyl-pyrimidine-1,3-diium-5-id-4-yl)carbonimidoyl]oxy-3-oxo-propoxy]-oxido-phosphoryl] [2-[(2-λ1-azanyl-6-oxo-purine-1,3-diium-9-yl)methoxy]-3-oxo-propyl] phosphate
Molecular Mass 704.394 g·mol−1
Heat of Formation -2711.9 ± 16.7 kJ·mol−1
Dipole Moment 2.90 ± 1.08 D
Volume 709.83 Å 3
Surface Area 553.07 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy -2.04 ± eV
Point Group Symmetry C1
Synonyms
  • [[(2r,3s,4r,5r)-5-(2-amino-6-keto-3h-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3s,4r,5r)-5-(2-amino-6-keto-3h-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate
  • [[(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3,4-dihydroxy-2-tetrahydrofuranyl]methoxy-hydroxyphosphoryl] [(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl hydrogen phosphate
  • [[(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl hydrogen phosphate
  • [[(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate
  • [[(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
  • guanosine 5'-(trihydrogen diphosphate), 5'-5'-ester with guanosine
  • guanosine 5'-diphospho-5'-guanosine
CAS Number(s)
  • 34692-44-9
InChIKey LFEYGVXBDRXHGF-MHARETSRSA-N
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