7-Allyl-8-Oxoguanosine

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Properties Simple | Detailed

Formula C13H17N5O6
IUPAC Name 7-allyl-2-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3h-purine-1,7,9-triium-6,8-dione
Molecular Mass 339.304 g·mol−1
Heat of Formation -825.4 ± 16.7 kJ·mol−1
Dipole Moment 7.44 ± 1.08 D
Volume 365.64 Å 3
Surface Area 306.28 Å 2
HOMO Energy -8.62 ± 0.55 eV
LUMO Energy -0.19 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-prop-2-enyl-3h-purine-6,8-dione
  • 7-allyl-2-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-3h-purine-6,8-dione
  • 7-allyl-2-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3h-purine-6,8-dione
  • 7-allyl-2-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-3h-purine-6,8-quinone
  • 7-allyl-2-amino-9-beta-d-ribofuranosylpurine-6,8(1h,9h)-dione
  • 7-allyl-7,8-dihydro-8-oxoguanosine
  • 7a8ogua
  • d04787
  • guanosine, 7,8-dihydro-8-oxo-7-(2-propenyl)-
  • loxoribine
  • loxoribine (usan)
  • rwj 21757
  • rwj-21757
CAS Number(s)
  • 121288-39-9
InChIKey VDCRFBBZFHHYGT-IOSLPCCCSA-N
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