3-[5-O-(Hydroxy{[Hydroxy(Phosphonoamino)Phosphoryl]Oxy}Phosphoryl)-β-D-Ribofuranosyl]-3H-Imidazo[2,1-I]Purine

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Properties Simple | Detailed

Formula C12H17N6O12P3
IUPAC Name [[(2r,3s,4r,5r)-5-(7,8-dihydroimidazo[2,1-f]purine-1,4,6-triium-7,8,9a-triylium-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-oxido-phosphoryl]oxy-phosphonatoazanidyl-phosphinate
Molecular Mass 530.218 g·mol−1
Heat of Formation -1242.5 ± 16.7 kJ·mol−1
Dipole Moment 5.46 ± 1.08 D
Volume 484.5 Å 3
Surface Area 362.09 Å 2
Point Group Symmetry C1
Synonyms
  • 1,n(6)-etheno-imido atp
  • 3h-imidazo(2,1-i)purine, 3-(5-o-(hydroxy((hydroxy(phosphonoamino)phosphinyl)oxy)phosphinyl)-beta-d-ribofuranosyl)-
  • [[[[(2r,3s,4r,5r)-3,4-dihydroxy-5-(3-imidazo[2,1-f]purinyl)-2-tetrahydrofuranyl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]amino]phosphonic acid
  • [[[[(2r,3s,4r,5r)-3,4-dihydroxy-5-imidazo[2,1-f]purin-3-yl-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]amino]phosphonic acid
  • [[[[(2r,3s,4r,5r)-3,4-dihydroxy-5-imidazo[2,1-f]purin-3-yl-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]amino]phosphonic acid
  • [[[[(2r,3s,4r,5r)-3,4-dihydroxy-5-imidazo[2,1-f]purin-3-yloxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]amino]phosphonic acid
  • epsilon-amppnp
  • ethenoadenylyl imidodiphosphate
CAS Number(s)
  • 78368-53-3
InChIKey RQUIQSICXGYQBT-WOUKDFQISA-N
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