[(5S,7R,8S,9R)-8,9-Dihydroxy-2,4-Dioxo-6-Oxa-1,3-Diazaspiro[4.4]Non-7-Yl]Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C7H11N2O9P
IUPAC Name [(5s,7r,8s,9r)-8,9-dihydroxy-2,4-dioxo-6-oxa-1,3-diazaspiro[4.4]nonan-7-yl]methyl dihydrogen phosphate
Molecular Mass 298.144 g·mol−1
Heat of Formation -1895.2 ± 16.7 kJ·mol−1
Dipole Moment 1.06 ± 1.08 D
Volume 286.29 Å 3
Surface Area 263.22 Å 2
HOMO Energy -10.47 ± 0.55 eV
LUMO Energy -0.57 ± eV
Point Group Symmetry C1
Synonyms
  • [(2r,3s,4r,5s)-3,4-dihydroxy-7,9-diketo-1-oxa-6,8-diazaspiro[4.4]nonan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5s)-3,4-dihydroxy-7,9-dioxo-1-oxa-6,8-diazaspiro[4.4]nonan-2-yl]methyl dihydrogen phosphate
  • h5p
  • hnp
  • hydantocidin-5'-monophosphate
  • hydantocidin-5'-phosphate
InChIKey HVXIMXHBUJADCC-GTBMBKLPSA-N
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