8-Oxo-7,8-Dihydroinosine 5'-(Dihydrogen Phosphate)

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Properties Simple | Detailed

Formula C10H13N4O9P
IUPAC Name [(2r,3s,4r,5r)-5-(6,8-dioxo-3,7-dihydropurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 364.205 g·mol−1
Heat of Formation -1725.4 ± 16.7 kJ·mol−1
Dipole Moment 7.23 ± 1.08 D
Volume 355.82 Å 3
Surface Area 299.29 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
Synonyms
  • 5'-inosinic acid, 7,8-dihydro-8-oxo-, homopolymer
  • 8-hydroxyinosine monophosphate homopolymer
  • [(2r,3s,4r,5r)-5-(6,8-diketo-3,7-dihydropurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6,8-dioxo-3,7-dihydropurin-9-yl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6,8-dioxo-3,7-dihydropurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6,8-dioxo-3,7-dihydropurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6,8-dioxo-3,7-dihydropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
  • poly-8-oxyinosinic acid
CAS Number(s)
  • 83614-18-0
InChIKey BDCQAPZSKDPNKT-UUOKFMHZSA-N
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