Dihydroneopterin Triphosphate

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Properties Simple | Detailed

Formula C9H17N5O13P3+
IUPAC Name [[(2r,3s)-3-(2-amino-4-oxo-7,8-dihydropteridin-1-ium-3-id-6-yl)-2,3-dihydroxy-propoxy]-hydroxy-phosphoryl] phosphono hydrogen phosphate
Molecular Mass 496.178 g·mol−1
Heat of Formation -3072.6 ± 16.7 kJ·mol−1
Dipole Moment 9.61 ± 1.08 D
Volume 471.09 Å 3
Surface Area 392.34 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -1.44 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s)-3-(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)-2,3-dihydroxypropyl tetrahydrogen triphosphate
  • 2-amino-4-hydroxy-6-(erythro-1,2,3-trihydroxypropyl)dihydropteridinetriphosphate
  • 6-(l-erythro-1,2-dihydroxy-3-triphosphooxypropyl)-7,8-dihydropterin
  • 6-(l-erythro-1,2-dihydroxypropyl 3-triphosphate)-7,8-dihydropterin
  • 6-[(1s,2r)-1,2-dihydroxy-3-triphosphooxypropyl]-7,8-dihydropterin
  • 7,8-dihydroneopterin 3'-triphosphate
  • [(2r,3s)-3-(2-amino-4-keto-7,8-dihydro-1h-pteridin-6-yl)-2,3-dihydroxy-propyl] (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2r,3s)-3-(2-amino-4-oxo-7,8-dihydro-1h-pteridin-6-yl)-2,3-dihydroxy-propyl] (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2r,3s)-3-(2-amino-4-oxo-7,8-dihydro-1h-pteridin-6-yl)-2,3-dihydroxypropyl] (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
  • triphosphoric acid, p-(3-(2-amino-1,4,7,8-tetrahydro-4-oxo-6-pteridinyl)-2,3-dihydroxypropyl) ester, (r*,s*)-
CAS Number(s)
  • 20574-65-6
InChIKey DGGUVLXVLHAAGT-XINAWCOVSA-N
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