4,6,7-Trimethyl-3-(D-Ribofuranosyl)-3,4-Dihydro-9H-Imidazo[1,2-A]Purin-9-One

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Properties Simple | Detailed

Formula C15H21N5O5
IUPAC Name 3-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4,6,7-trimethyl-imidazo[1,2-a]purine-1,5-diium-3a,7-diid-9-one
Molecular Mass 351.358 g·mol−1
Heat of Formation -583.1 ± 16.7 kJ·mol−1
Dipole Moment 5.33 ± 1.08 D
Volume 382.53 Å 3
Surface Area 328.28 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy 2.41 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-4,6,7-trimethyl-9-imidazo[1,2-a]purinone
  • 3-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6,7-trimethyl-imidazo[1,2-a]purin-9-one
  • 3-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6,7-trimethylimidazo[1,2-a]purin-9-one
  • 3-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4,6,7-trimethyl-imidazo[1,2-a]purin-9-one
  • 3-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-4,6,7-trimethyl-imidazo[1,2-a]purin-9-one
InChIKey HOEIPINIBKBXTJ-IDTAVKCVSA-N
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