1-[5-O-(β-D-Glucopyranosyl)-β-D-Ribofuranosyl]-1H-1,2,4-Triazole-3-Carboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C14H22N4O10
IUPAC Name 1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydrofuran-2-yl]-4-aza-1-azonia-2-azanidacyclopenta-3,5-diene-3-carboxamide
Molecular Mass 406.345 g·mol−1
Heat of Formation -1593.0 ± 16.7 kJ·mol−1
Dipole Moment 4.49 ± 1.08 D
Volume 433.42 Å 3
Surface Area 350.46 Å 2
HOMO Energy -10.01 ± 0.55 eV
LUMO Energy -0.76 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxymethyl]-2-tetrahydrofuranyl]-1,2,4-triazole-3-carboxamide
  • 1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxolan-2-yl]-1,2,4-triazole-3-carboxamide
  • 1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydrofuran-2-yl]-1,2,4-triazole-3-carboxamide
  • 1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxymethyl]tetrahydrofuran-2-yl]-1,2,4-triazole-3-carboxamide
  • 5'-o-beta-d-glucopyranosyl ribavirin
  • 5'-o-glucopyranosyl ribavirin
CAS Number(s)
  • 114283-60-2
InChIKey DDEVDOFIWICGEW-MKUQHPNPSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N