[2-[(2-Amino-6-Oxo-3H-Purin-9-Yl)Methoxy]Ethoxy-Hydroxy-Phosphoryl]Oxy-[[(1R)-2-(6-Aminopurin-9-Yl)-1-Methyl-Ethoxy]Methyl]Phosphinic Acid

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Properties Simple | Detailed

Formula C17H24N10O9P2
IUPAC Name [2-[(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)methoxy]ethoxy-hydroxy-phosphoryl]oxy-[[(1r)-2-(6-aminopurine-1,3,7-triium-9-yl)-1-methyl-ethoxy]methyl]phosphinic acid
Molecular Mass 574.382 g·mol−1
Heat of Formation -1674.4 ± 16.7 kJ·mol−1
Dipole Moment 9.36 ± 1.08 D
Volume 596.65 Å 3
Surface Area 422.66 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -1.29 ± eV
Point Group Symmetry C1
Synonyms
  • 9-((r)-2-phosphonomethoxypropyl)adenine)-acyclovir monophosphate dinucleotide
  • 9-((r)-2-phosphonomethoxypropyl)adenine)-acyclovir monophosphate dinucleotide in red blood cells
  • [2-[(2-amino-6-keto-3h-purin-9-yl)methoxy]ethoxy-hydroxy-phosphoryl]oxy-[[(1r)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl]phosphinic acid
  • [2-[(2-amino-6-oxo-3h-purin-9-yl)methoxy]ethoxy-hydroxy-phosphoryl]oxy-[[(2r)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl]phosphinic acid
  • [2-[(2-amino-6-oxo-3h-purin-9-yl)methoxy]ethoxy-hydroxyphosphoryl]oxy-[[(1r)-2-(6-amino-9-purinyl)-1-methylethoxy]methyl]phosphinic acid
  • [2-[(2-amino-6-oxo-3h-purin-9-yl)methoxy]ethoxy-hydroxyphosphoryl]oxy-[[(2r)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl]phosphinic acid
  • acvppmpa
  • acyclovir-pmpa heterodinucleotide
InChIKey VVPOUXLAZDNDKV-SNVBAGLBSA-N
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