2-Amino-7-(β-D-Ribofuranosyl)-1,7-Dihydro-4H-Pyrrolo[2,3-D]Pyrimidin-4-One

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Properties Simple | Detailed

Formula C11H14N4O5
IUPAC Name 2-amino-7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1h-pyrrolo[2,3-d]pyrimidin-4-one
Molecular Mass 282.253 g·mol−1
Heat of Formation -663.8 ± 16.7 kJ·mol−1
Dipole Moment 10.57 ± 1.08 D
Volume 303.87 Å 3
Surface Area 271.62 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 3.14 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-1h-pyrrolo[3,2-e]pyrimidin-4-one
  • 2-amino-7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1h-pyrrolo[3,2-e]pyrimidin-4-one
  • 2-amino-7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1h-pyrrolo[3,2-e]pyrimidin-4-one
  • 2-amino-7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-1h-pyrrolo[3,2-e]pyrimidin-4-one
  • 4h-pyrrolo(2,3-d)pyrimidin-4-one, 2-amino-1,7-dihydro-7-beta-d-ribofuranosyl-
  • 7-deazaguanosine
  • 7-dzguo
CAS Number(s)
  • 62160-23-0
InChIKey JRYMOPZHXMVHTA-DAGMQNCNSA-N
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