5-S-Methyl-1-O-Phosphono-5-Thio-β-D-Ribofuranose

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Properties Simple | Detailed

Formula C6H13O7PS
IUPAC Name [(2s,3r,4s,5s)-3,4-dihydroxy-5-(methylsulfanylmethyl)tetrahydrofuran-2-yl] dihydrogen phosphate
Molecular Mass 260.202 g·mol−1
Heat of Formation -1631.7 ± 16.7 kJ·mol−1
Dipole Moment 3.24 ± 1.08 D
Volume 265.15 Å 3
Surface Area 239.41 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy -0.24 ± eV
Point Group Symmetry C1
Synonyms
  • [(2s,3r,4s,5s)-3,4-dihydroxy-5-(methylsulfanylmethyl)oxolan-2-yl] dihydrogen phosphate
  • [(2s,3r,4s,5s)-3,4-dihydroxy-5-(methylsulfanylmethyl)tetrahydrofuran-2-yl] dihydrogen phosphate
  • [(2s,3r,4s,5s)-3,4-dihydroxy-5-[(methylthio)methyl]-2-tetrahydrofuranyl] dihydrogen phosphate
  • [(2s,3r,4s,5s)-3,4-dihydroxy-5-[(methylthio)methyl]tetrahydrofuran-2-yl] dihydrogen phosphate
  • s-methyl-5-thio-5-deoxy-d-ribose 1-phosphate
  • s-methyl-5-thio-alpha-d-ribose 1-phosphate
  • s-methyl-5-thio-d-ribose 1-phosphate
InChIKey JTFITTQBRJDSTL-KAZBKCHUSA-N
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