(2R,3R,4R,5R)-5-(6-Amino-9H-Purin-9-Yl)-N-Ethyl-3,4-Dihydroxytetrahydro-2-Furancarboxamide

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Formula C12H16N6O4
IUPAC Name (2r,3r,4r,5r)-5-(6-aminopurin-9-yl)-n-ethyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide
Molecular Mass 308.293 g·mol−1
Heat of Formation -471.0 ± 16.7 kJ·mol−1
Dipole Moment 3.63 ± 1.08 D
Volume 339.24 Å 3
Surface Area 310.26 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy 2.40 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4r,5r)-5-(6-amino-9-purinyl)-n-ethyl-3,4-dihydroxy-2-tetrahydrofurancarboxamide
  • (2r,3r,4r,5r)-5-(6-aminopurin-9-yl)-n-ethyl-3,4-dihydroxy-oxolane-2-carboxamide
  • (2r,3r,4r,5r)-5-(6-aminopurin-9-yl)-n-ethyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide
  • (2r,3r,4r,5r)-5-(6-aminopurin-9-yl)-n-ethyl-3,4-dihydroxyoxolane-2-carboxamide
  • tocris-1691
InChIKey JADDQZYHOWSFJD-BMYQGPEFSA-N
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