2'-Deoxy-5'-O-(Hydroxy{[(2R,3R,5R)-3-(Hydroxymethyl)-5-(5-Methyl-2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)Tetrahydro-2-Furanyl]Oxy}Phosphoryl)Guanosine

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Properties Simple | Detailed

Formula C20H26N7O11P
IUPAC Name [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2r,3r,5r)-3-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl] hydrogen phosphate
Molecular Mass 571.435 g·mol−1
Heat of Formation -2042.1 ± 16.7 kJ·mol−1
Dipole Moment 14.91 ± 1.08 D
Volume 594.02 Å 3
Surface Area 424.77 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -0.90 ± eV
Point Group Symmetry C1
Synonyms
  • [(2r,3s,5r)-5-(2-amino-6-keto-3h-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2r,3r,5r)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-3-methylol-tetrahydrofuran-2-yl] hydrogen phosphate
  • [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxy-2-tetrahydrofuranyl]methyl [(2r,3r,5r)-3-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-tetrahydrofuranyl] hydrogen phosphate
  • [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxy-oxolan-2-yl]methyl [(2r,3r,5r)-3-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)oxolan-2-yl] hydrogen phosphate
  • [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2r,3r,5r)-3-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl] hydrogen phosphate
  • d(tpg)
  • guanosine, thymidylyl-(3'-5')-2'-deoxy-
  • thymidylyl phosphate deoxyguanosine
  • thymidylyl-(3',5')-2'-deoxyguanosine
CAS Number(s)
  • 144740-34-1
  • 4251-20-1
InChIKey IBIDWGFEZKUPJD-FJLHAGFDSA-N
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