6-Hydroxymethyl-9-β-D-Ribofuranosylpurine

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Formula C11H14N4O5
IUPAC Name (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[6-(hydroxymethyl)purin-9-ium-9-yl]tetrahydrofuran-3,4-diol
Molecular Mass 282.253 g·mol−1
Heat of Formation -637.4 ± 16.7 kJ·mol−1
Dipole Moment 2.53 ± 1.08 D
Volume 303.34 Å 3
Surface Area 272.44 Å 2
HOMO Energy -10.17 ± 0.55 eV
LUMO Energy -1.36 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[6-(hydroxymethyl)-9-purinyl]tetrahydrofuran-3,4-diol
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[6-(hydroxymethyl)purin-9-yl]oxolane-3,4-diol
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[6-(hydroxymethyl)purin-9-yl]tetrahydrofuran-3,4-diol
  • (2r,3s,4r,5r)-2-methylol-5-(6-methylolpurin-9-yl)tetrahydrofuran-3,4-diol
InChIKey QBCRXYXVIXBVGH-PNHWDRBUSA-N
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