(1S,2S,3R,4R,5R,6R)-3,5,6-Trihydroxy-1,2,4-Cyclohexanetriyl Tris[Dihydrogen (Phosphate)]

Molecule SVG Image

Properties Simple | Detailed

Formula C6H15O15P3
IUPAC Name [(1s,2r,3r,4r,5r,6s)-2,3,5-trihydroxy-4,6-diphosphonooxy-cyclohexyl] dihydrogen phosphate
Molecular Mass 420.096 g·mol−1
Heat of Formation -3698.2 ± 16.7 kJ·mol−1
Dipole Moment 8.36 ± 1.08 D
Volume 383.53 Å 3
Surface Area 318.9 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy -0.85 ± eV
Point Group Symmetry C1
Synonyms
  • [(1s,2r,3r,4r,5r,6s)-2,4,5-trihydroxy-3,6-diphosphonooxy-cyclohexyl] dihydrogen phosphate
  • [(1s,2r,3r,4r,5r,6s)-2,4,5-trihydroxy-3,6-diphosphonooxycyclohexyl] dihydrogen phosphate
InChIKey MMWCIQZXVOZEGG-SHFUYGGZSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C O H