(4R,5S,6R)-4,5,6-Trihydroxy-2-Oxo-7-(Phosphonooxy)Heptanoic Acid

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Properties Simple | Detailed

Formula C7H13O10P
IUPAC Name (4r,5s,6r)-4,5,6-trihydroxy-2-oxo-7-phosphonooxy-heptanoic acid
Molecular Mass 288.146 g·mol−1
Heat of Formation -2154.6 ± 16.7 kJ·mol−1
Dipole Moment 3.02 ± 1.08 D
Volume 292.02 Å 3
Surface Area 275.84 Å 2
HOMO Energy -10.25 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C1
Synonyms
  • (4r,5s,6r)-4,5,6-trihydroxy-2-keto-7-phosphonooxy-enanthic acid
  • (4r,5s,6r)-4,5,6-trihydroxy-2-oxo-7-phosphonooxy-heptanoic acid
  • 2-dahp
  • 2-dehydro-3-deoxy-d-arabino-heptulosonic acid-7-phosphate
  • 3-deoxy-7-o-phosphono-d-arabino-hept-2-ulosonic acid
  • 3-deoxy-arabino-heptulonate 7-phosphate
  • 3-deoxy-d-arabino-2-heptulosonic acid 7-(dihydrogen phosphate)
  • 3-deoxy-d-arabino-hept-2-ulosonate 7-phosphate
  • 3-deoxy-d-arabino-heptulosonic acid 7-phosphate
  • 3-deoxyarabinoheptulosonate-7-phosphate
  • 7-phospho-2-dehydro-3-deoxy-d-arabino-heptonic acid
  • 7-phospho-2-keto-3-deoxy-d-arabinoheptonate
  • d-arabino-2-heptulosonic acid, 3-deoxy-, 7-(dihydrogen phosphate)
  • dahp
InChIKey PJWIPEXIFFQAQZ-PUFIMZNGSA-N
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