2'-Deoxy-2-Oxo-2-Hydroadenosine 5'-(Dihydrogen Phosphate)

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Formula C10H14N5O7P
IUPAC Name [(2r,3s,5r)-5-(6-amino-2-oxo-1h-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 347.221 g·mol−1
Heat of Formation 77.9 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 334.84 Å 3
Surface Area 324.62 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -1.81 ± eV
Point Group Symmetry C1
Synonyms
  • 2'-deoxyisoguanine-5'-monophosphate
  • [(2r,3s,5r)-5-(6-amino-2-keto-1h-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,5r)-5-(6-amino-2-oxo-1h-purin-9-yl)-3-hydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,5r)-5-(6-amino-2-oxo-1h-purin-9-yl)-3-hydroxy-oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,5r)-5-(6-amino-2-oxo-1h-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • igu
InChIKey GEQDRKVFKBSPSW-KVQBGUIXSA-N
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