9B-D-Psicofuranosyladenine

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Properties Simple | Detailed

Formula C11H15N5O5
IUPAC Name (2r,3r,4s,5r)-2-(6-aminopurin-9-ium-9-yl)-2,5-bis(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 297.267 g·mol−1
Heat of Formation -667.5 ± 16.7 kJ·mol−1
Dipole Moment 2.46 ± 1.08 D
Volume 318.2 Å 3
Surface Area 274.75 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-(6-amino-9-purinyl)-2,5-bis(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-(6-aminopurin-9-yl)-2,5-bis(hydroxymethyl)oxolane-3,4-diol
  • (2r,3r,4s,5r)-2-(6-aminopurin-9-yl)-2,5-bis(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-(6-aminopurin-9-yl)-2,5-dimethylol-tetrahydrofuran-3,4-diol
  • 9-beta-d-psicofuranosyl-9h-purin-6-amine
  • 9-beta-d-psicofuranosyladenine
  • 9h-purin-6-amine, 9-beta-d-psicofuranosyl- (9ci)
  • 9h-purine, 6-amino-9-beta-d-psicofuranosyl-
  • adenine, 9beta-d-psicofuranosyl-
  • angustmycin c
  • pdsp1_001037
  • pdsp2_001021
  • psicofuranin
CAS Number(s)
  • 1874-54-0
InChIKey BNZYRKVSCLSXSJ-IOSLPCCCSA-N
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