[(2R,3S,5R)-3-{[{[(2R,3S,5R)-5-(4-Amino-5-Methyl-2-Oxo-1(2H)-Pyrimidinyl)-3-Hydroxytetrahydro-2-Furanyl]Methoxy}(Hydroxy)Phosphoryl]Oxy}-5-(2-Amino-6-Oxo-3,6-Dihydro-9H-Purin-9-Yl)Tetrahydro-2-Furanyl]Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C20H28N8O13P2
IUPAC Name [(2r,3s,5r)-5-(4-amino-5-methyl-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] hydrogen phosphate
Molecular Mass 650.430 g·mol−1
Heat of Formation -2630.1 ± 16.7 kJ·mol−1
Dipole Moment 9.97 ± 1.08 D
Volume 668.42 Å 3
Surface Area 468.45 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy -0.87 ± eV
Point Group Symmetry C1
Synonyms
  • 5'-guanylic acid, 2'-deoxy-5-methylcytidylyl-(5'-3')-2'-deoxy-, homopolymer
  • [(2r,3s,5r)-5-(4-amino-2-keto-5-methyl-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2r,3s,5r)-5-(2-amino-6-keto-3h-purin-9-yl)-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] hydrogen phosphate
  • [(2r,3s,5r)-5-(4-amino-5-methyl-2-oxo-1-pyrimidinyl)-3-hydroxy-2-tetrahydrofuranyl]methyl [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-2-(phosphonooxymethyl)-3-tetrahydrofuranyl] hydrogen phosphate
  • [(2r,3s,5r)-5-(4-amino-5-methyl-2-oxo-pyrimidin-1-yl)-3-hydroxy-oxolan-2-yl]methyl [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-2-(phosphonooxymethyl)oxolan-3-yl] hydrogen phosphate
  • [(2r,3s,5r)-5-(4-amino-5-methyl-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] hydrogen phosphate
  • [(2r,3s,5r)-5-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-2-(phosphonooxymethyl)oxolan-3-yl] hydrogen phosphate
  • pdgmdc
  • poly d(gme5c)
  • poly(dg-dmec)
  • poly(dg-m(5)dc)
  • poly(dg-m(5)dc).poly(dg-m(5)dc)
CAS Number(s)
  • 51853-63-5
InChIKey JAPHKTOVZDCDRM-PRSXHHODSA-N
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