5'-O-Thiophosphonoguanosine

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Properties Simple | Detailed

Formula C10H14N5O7PS
IUPAC Name 2-amino-9-[(2r,3r,4s,5r)-5-(dihydroxyphosphinothioyloxymethyl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-3h-purin-6-one
Molecular Mass 379.286 g·mol−1
Heat of Formation -1235.8 ± 16.7 kJ·mol−1
Dipole Moment 15.24 ± 1.08 D
Volume 386.19 Å 3
Surface Area 335.81 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-9-[(2r,3r,4s,5r)-5-(dihydroxyphosphinothioyloxymethyl)-3,4-dihydroxy-2-tetrahydrofuranyl]-3h-purin-6-one
  • 2-amino-9-[(2r,3r,4s,5r)-5-(dihydroxyphosphinothioyloxymethyl)-3,4-dihydroxy-oxolan-2-yl]-3h-purin-6-one
  • 2-amino-9-[(2r,3r,4s,5r)-5-(dihydroxyphosphinothioyloxymethyl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-3h-purin-6-one
  • 2-amino-9-[(2r,3r,4s,5r)-5-(dihydroxyphosphinothioyloxymethyl)-3,4-dihydroxyoxolan-2-yl]-3h-purin-6-one
  • 2-amino-9-[(2r,3r,4s,5r)-5-(dihydroxythiophosphoryloxymethyl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-3h-purin-6-one
InChIKey DIDGPCDGNMIUNX-UUOKFMHZSA-N
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