1-Methylinosine 5'-(Dihydrogen Phosphate)

Molecule SVG Image

Properties Simple | Detailed

Formula C11H17N4O8P+
IUPAC Name [(2r,3s,4r,5r)-3,4-dihydroxy-5-(1-methyl-6-oxo-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 364.248 g·mol−1
Heat of Formation -1534.3 ± 16.7 kJ·mol−1
Dipole Moment 9.44 ± 1.08 D
Volume 360.47 Å 3
Surface Area 298.98 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy -1.26 ± eV
Point Group Symmetry C1
Synonyms
  • 5'-inosinic acid, 1-methyl-, homopolymer
  • [(2r,3s,4r,5r)-3,4-dihydroxy-5-(1-methyl-6-oxo-9-purinyl)-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-3,4-dihydroxy-5-(1-methyl-6-oxo-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-3,4-dihydroxy-5-(1-methyl-6-oxo-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-3,4-dihydroxy-5-(1-methyl-6-oxopurin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-3,4-dihydroxy-5-(6-keto-1-methyl-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • poly(1-methylinosinic acid)
CAS Number(s)
  • 29855-89-8
InChIKey CPKNFRPSNBOHIM-IOSLPCCCSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N