7-Methyl-8-Thioxoguanosine

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Properties Simple | Detailed

Formula C11H15N5O5S
IUPAC Name 2-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-7-methyl-8-thioxo-3h-purine-1,7,9-triium-6-one
Molecular Mass 329.332 g·mol−1
Heat of Formation -644.6 ± 16.7 kJ·mol−1
Dipole Moment 7.17 ± 1.08 D
Volume 343.16 Å 3
Surface Area 291.82 Å 2
HOMO Energy -8.22 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-7-methyl-8-thioxo-3h-purin-6-one
  • 2-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-7-methyl-8-thioxo-3h-purin-6-one
  • 2-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-7-methyl-8-thioxo-3h-purin-6-one
  • 6h-purin-6-one, 2-amino-1,7,8,9-tetrahydro-7-methyl-9-b-d-ribofuranosyl-8-thioxo-
  • 7,8-dihydro-7-methyl-8-thioxoguanosine
  • 7,8-dmtog
  • guanosine, 7,8-dihydro-7-methyl-8-thioxo-
CAS Number(s)
  • 127794-14-3
InChIKey RYCBQZRMWCNRMH-UUOKFMHZSA-N
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