2-Amino-9-(α-D-Arabinofuranosyl)-1-Methyl-1,9-Dihydro-6H-Purin-6-One

Molecule SVG Image

Properties Simple | Detailed

Formula C11H15N5O5
IUPAC Name 2-amino-9-[(2s,3s,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1-methyl-purine-3,7-diium-6-one
Molecular Mass 297.267 g·mol−1
Heat of Formation -661.7 ± 16.7 kJ·mol−1
Dipole Moment 5.25 ± 1.08 D
Volume 323.25 Å 3
Surface Area 289.73 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy -0.78 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-9-[(2s,3s,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-1-methyl-6-purinone
  • 2-amino-9-[(2s,3s,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-methyl-purin-6-one
  • 2-amino-9-[(2s,3s,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-methylpurin-6-one
  • 2-amino-9-[(2s,3s,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1-methyl-purin-6-one
  • 2-amino-9-[(2s,3s,4s,5r)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-1-methyl-purin-6-one
InChIKey UTAIYTHAJQNQDW-KMPDEGCQSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N