P(1),P(4)-Bis(5'-Adenosyl) Tetraphosphate

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Properties Simple | Detailed

Formula C20H28N10O19P4
IUPAC Name [[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [[[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl] hydrogen phosphate
Molecular Mass 836.387 g·mol−1
Heat of Formation -1641.5 ± 16.7 kJ·mol−1
Dipole Moment 23.56 ± 1.08 D
Volume 743.32 Å 3
Surface Area 529.15 Å 2
HOMO Energy -7.25 ± 0.55 eV
LUMO Energy -4.48 ± eV
Point Group Symmetry C1
Synonyms
  • (ppa)2
  • 5',5'''-diadenosine tetraphosphate
  • [[(2r,3s,4r,5r)-5-(6-amino-9-purinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methoxy-hydroxyphosphoryl]oxy-[[[(2r,3s,4r,5r)-5-(6-amino-9-purinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methoxy-hydroxyphosphoryl]oxy-dihydroxyphosphaniumyl]oxy-dihydroxyphosphonium
  • [[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-dihydroxy-phosphaniumyl]oxy-dihydroxy-phosphanium
  • [[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-[[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-dihydroxy-phosphaniumyl]oxy-dihydroxy-phosphonium
  • [[[[(2r,3s,4r,5r)-5-(6-amino-9-purinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] [(2r,3s,4r,5r)-5-(6-amino-9-purinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl hydrogen phosphate
  • [[[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl] [(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl hydrogen phosphate
  • [[[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl] [(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate
  • [[[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] [(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
  • a(5')p4(5')a
  • adenosine 5'-(pentahydrogen tetraphosphate), 5'-5'-ester with adenosine
  • adenosine 5'-tetraphosphate, 5'-ester with adenosine (7ci)
  • adenosine(5')tetraphospho(5')adenosine
  • appppa
  • b4p
  • bis(5'-adenylyl) diphosphate
  • bis(adenosine)-5'-tetraphosphate
  • diadenosine 5',5'''-p(sup 1),p(sup 2)-tetraphosphate
  • diadenosine tetraphosphate
  • p1,p4-bis(5'-adenosyl) tetraphosphate
CAS Number(s)
  • 117137-55-0
  • 5542-28-9
InChIKey YOAHKNVSNCMZGQ-XPWFQUROSA-N
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