[(2R,3S,5R)-5-(2-Amino-6-Oxo-3,6-Dihydro-9H-Purin-9-Yl)-3-Hydroxytetrahydro-2-Furanyl]Methyl (2R,3S,5R)-5-(6-Amino-9H-Purin-9-Yl)-2-(Hydroxymethyl)Tetrahydro-3-Furanyl Hydrogen Phosphate (Non-Preferred Name)

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Properties Simple | Detailed

Formula C20H26N10O9P
IUPAC Name [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2r,3s,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl] hydrogen phosphate
Molecular Mass 581.456 g·mol−1
Heat of Formation -1359.1 ± 16.7 kJ·mol−1
Dipole Moment 8.05 ± 1.08 D
Volume 609.98 Å 3
Surface Area 500.18 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -1.02 ± 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,3s,5r)-5-(6-aminopurin-9-yl)-2-methylol-tetrahydrofuran-3-yl] hydrogen phosphate
  • [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxy-2-tetrahydrofuranyl]methyl [(2r,3s,5r)-5-(6-amino-9-purinyl)-2-(hydroxymethyl)-3-tetrahydrofuranyl] hydrogen phosphate
  • [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxy-oxolan-2-yl]methyl [(2r,3s,5r)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate
  • [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2r,3s,5r)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl] hydrogen phosphate
  • [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl [(2r,3s,5r)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate
  • d(apg)
  • da(3'-5')dg
  • deoxy(adenosine monophosphate guanosine)
  • deoxyadenylyl-(3'-5')-deoxyguanosine
  • guanosine, 2'-deoxyadenylyl-(3'-5')-2'-deoxy-
CAS Number(s)
  • 4336-87-2
InChIKey HCGVHZGSMKEALA-LSUSWQKBSA-N
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