(1R,2S,3S,4R,5R,6S)-5,6-Dihydroxy-1,2,3,4-Cyclohexanetetrayl Tetrakis[Dihydrogen (Phosphate)]

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Formula C6H16O18P4
IUPAC Name [(1r,2s,3r,4r,5s,6s)-2,3-dihydroxy-4,5,6-triphosphonooxy-cyclohexyl] dihydrogen phosphate
Molecular Mass 500.075 g·mol−1
Heat of Formation -4623.9 ± 16.7 kJ·mol−1
Dipole Moment 5.25 ± 1.08 D
Volume 439.95 Å 3
Surface Area 338.64 Å 2
HOMO Energy -9.73 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
Synonyms
  • 1d-myo-inositol 1,4,5,6-tetrakis(dihydrogen phosphate)
  • 1d-myo-inositol 1,4,5,6-tetrakisphosphate
  • [(1s,2r,3s,4r,5r,6s)-3,4-dihydroxy-2,5,6-triphosphonooxy-cyclohexyl] dihydrogen phosphate
  • [(1s,2r,3s,4r,5r,6s)-3,4-dihydroxy-2,5,6-triphosphonooxycyclohexyl] dihydrogen phosphate
  • d-myo-inositol 1,4,5,6-tetrakisphosphate
  • inositol 1,4,5,6-tetrakisphosphate
CAS Number(s)
  • 121010-58-0
InChIKey MRVYFOANPDTYBY-YORTWTKJSA-N
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