(2R,3R,4S,5R)-2-(4-Aminopyrrolo[2,3-D]Pyrimidin-7-Yl)-5-(Hydroxymethyl)Tetrahydrofuran-3,4-Diol

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Properties Simple | Detailed

Formula C11H15N4O4
IUPAC Name (2r,3r,4s,5r)-2-(4-aminopyrrolo[2,3-d]pyrimidine-1,3-diium-4a-id-7-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 267.261 g·mol−1
Heat of Formation -503.9 ± 16.7 kJ·mol−1
Dipole Moment 3.71 ± 1.08 D
Volume 291.44 Å 3
Surface Area 257.98 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-(4-amino-7-pyrrolo[2,3-d]pyrimidinyl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol
  • (2r,3r,4s,5r)-2-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-methylol-tetrahydrofuran-3,4-diol
  • 2-(4-amino-pyrrolo[2,3-d]pyrimidin-7-yl)-5-hydroxymethyl-tetrahydro-furan-3,4-diol
  • 4-amino-7-(beta-d-ribofuranosyl)-pyrrolo(2,3-d)pyrimidine
  • 4-amino-7-beta-d-ribofuranosyl-7h-pyrrolo(2,3-d)pyrimidine
  • 4-amino-7beta-d-ribofuranosyl-7h-pyrrolo(2,3-d)pyrimidine
  • 7-beta-cd-ribofuranosyl-7h-pyrrolo(2,3-d)pyrimidin-4-amine
  • 7-beta-d-ribofuranosyl-7h-pyrrolo(2,3-d)pyrimidine-4-amine
  • 7-beta-d-ribofuranosyl-7h-pyrrolo-(2,3-d)pyrimidin-4-amine (9ci)
  • 7beta-d-ribofuranosyl-7h-pyrrolo(2,3-d)pyrimidine-4-amine
  • 7h-pyrrolo(2,3-d)pyrimidin-4-amine, 7-beta-d-ribofuranosyl-
  • 7h-pyrrolo(2,3-d)pyrimidine, 4-amino-7-beta-d-ribofuranosyl-
  • 7h-pyrrolo(2,3-d)pyrimidine, 4-amino-7beta-d-ribofuranosyl-
  • antibiotic xk 101-1
  • tbn
  • u-10071
CAS Number(s)
  • 1409-52-5
InChIKey HDZZVAMISRMYHH-KCGFPETGSA-N
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