Adenosine 2'-(Dihydrogen Phosphate) 5'-(Trihydrogen Diphosphate)

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Formula C10H16N5O13P3
IUPAC Name [(2r,3r,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3-hydroxy-4-phosphonooxy-tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate
Molecular Mass 507.181 g·mol−1
Heat of Formation -3034.0 ± 16.7 kJ·mol−1
Dipole Moment 1.50 ± 1.08 D
Volume 478.22 Å 3
Surface Area 403.75 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy -1.41 ± eV
Point Group Symmetry C1
Synonyms
  • 2'-monophosphoadenosine-5'-diphosphate
  • 2'p-adp
  • 2-phospho-adenosine diphosphate
  • 5'-diphosphoadenosine 2'-phosphate
  • [(2r,3r,4r,5r)-5-(6-amino-9-purinyl)-3-hydroxy-4-phosphonooxy-2-tetrahydrofuranyl]methyl phosphono hydrogen phosphate
  • [(2r,3r,4r,5r)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxy-oxolan-2-yl]methyl phosphono hydrogen phosphate
  • [(2r,3r,4r,5r)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxy-tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate
  • [(2r,3r,4r,5r)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methyl phosphono hydrogen phosphate
  • adenosine 5'-(trihydrogen diphorphate), 2'-(dihydrogen phosphate)
  • atr
CAS Number(s)
  • 4457-01-6
InChIKey YPTPYQSAVGGMFN-KQYNXXCUSA-N
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