1-[2,3-Anhydro-5-O-(Hydroxy{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Phosphoryl)-β-D-Lyxofuranosyl]-5-Methyl-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C10H15N2O14P3
IUPAC Name [hydroxy-[[(1s,2r,4r,5s)-4-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate
Molecular Mass 480.152 g·mol−1
Heat of Formation -3292.1 ± 16.7 kJ·mol−1
Dipole Moment 7.53 ± 1.08 D
Volume 436.88 Å 3
Surface Area 332.34 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy -1.49 ± eV
Point Group Symmetry C1
Synonyms
  • (hydroxy-phosphonooxy-phosphoryl) [(1s,2r,4r,5s)-4-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl hydrogen phosphate
  • (hydroxy-phosphonooxyphosphoryl) [(1s,2r,4r,5s)-4-(5-methyl-2,4-dioxo-1-pyrimidinyl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl hydrogen phosphate
  • (hydroxy-phosphonooxyphosphoryl) [(1s,2r,4r,5s)-4-(5-methyl-2,4-dioxopyrimidin-1-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl hydrogen phosphate
  • 1-(2,3-anhydro-5-o-(hydroxy((hydroxy(phosphonooxy)phosphinyl)oxy)phosphinyl)-beta-d-lyxofuranosyl)-5-methyl-2,4(1h,3h)-pyrimidinedione
  • 2',3'-lyxoanhydrothymidine 5'-triphosphate
  • 2,4(1h,3h)-pyrimidinedione, 1-(2,3-anhydro-5-o-(hydroxy((hydroxy(phosphonooxy)phosphinyl)oxy)phosphinyl)-beta-d-lyxofuranosyl)-5-methyl-
  • [(1s,2r,4r,5s)-4-(2,4-diketo-5-methyl-pyrimidin-1-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • lattp
CAS Number(s)
  • 125676-73-5
InChIKey ZWTBOAKHQDZXMV-UTSKPXGSSA-N
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