Dtdp-4-Amino-4,6-Dideoxy-Α-D-Glucopyranose

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Properties Simple | Detailed

Formula C16H27N3O14P2++
IUPAC Name [(2r,3r,4s,5s,6r)-5-amino-3,4-dihydroxy-6-methyl-tetrahydropyran-2-yl] [hydroxy-[[(2r,3s,5r)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-ium-5-id-1-yl)tetrahydrofuran-2-yl]methoxy]phosphoryl] hydrogen phosphate
Molecular Mass 547.345 g·mol−1
Heat of Formation -3200.7 ± 16.7 kJ·mol−1
Dipole Moment 6.95 ± 1.08 D
Volume 562.03 Å 3
Surface Area 398.22 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy -1.66 ± eV
Point Group Symmetry C1
Synonyms
  • [(2r,3r,4s,5s,6r)-5-amino-3,4-dihydroxy-6-methyl-2-tetrahydropyranyl] [hydroxy-[[(2r,3s,5r)-3-hydroxy-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-tetrahydrofuranyl]methoxy]phosphoryl] hydrogen phosphate
  • [(2r,3r,4s,5s,6r)-5-amino-3,4-dihydroxy-6-methyl-oxan-2-yl] [hydroxy-[[(2r,3s,5r)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate
  • [(2r,3r,4s,5s,6r)-5-amino-3,4-dihydroxy-6-methyl-tetrahydropyran-2-yl] [[(2r,3s,5r)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] hydrogen phosphate
  • [(2r,3r,4s,5s,6r)-5-amino-3,4-dihydroxy-6-methyl-tetrahydropyran-2-yl] [hydroxy-[[(2r,3s,5r)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy]phosphoryl] hydrogen phosphate
  • [(2r,3r,4s,5s,6r)-5-amino-3,4-dihydroxy-6-methyloxan-2-yl] [hydroxy-[[(2r,3s,5r)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate
InChIKey UIVJXHWSIFBBCY-LPGAPTBISA-N
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