3-(2-Deoxy-α-D-Erythro-Pentofuranosyl)-3,4-Dihydro-9H-Imidazo[1,2-A]Purin-9-One

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Properties Simple | Detailed

Formula C12H15N5O4
IUPAC Name 3-[(2s,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4,7-dihydroimidazo[1,2-a]purine-1,5-diium-3a,7-diid-9-one
Molecular Mass 293.279 g·mol−1
Heat of Formation -327.2 ± 16.7 kJ·mol−1
Dipole Moment 8.05 ± 1.08 D
Volume 315.03 Å 3
Surface Area 284.54 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry C1
Synonyms
  • 1,n(2)-edguo
  • 1,n(2)-ethenodeoxyguanosine
  • 3-[(2s,4s,5r)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-4h-imidazo[1,2-a]purin-9-one
  • 3-[(2s,4s,5r)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4h-imidazo[1,2-a]purin-9-one
  • 3-[(2s,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4h-imidazo[1,2-a]purin-9-one
  • 3-[(2s,4s,5r)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-4h-imidazo[1,2-a]purin-9-one
  • 9h-imidazo(1,2-a)purin-9-one, 3-(2-deoxy-beta-d-erythro-pentofuranosyl)-3,4-dihydro-
CAS Number(s)
  • 108929-11-9
InChIKey UQJBQTAFGHUSKK-RNJXMRFFSA-N
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