N-({3-Hydroxy-2-Methyl-5-[(Phosphonooxy)Methyl]-4-Pyridinyl}Methyl)Glycine

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Properties Simple | Detailed

Formula C10H15N2O7P
IUPAC Name 2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]acetic acid
Molecular Mass 306.209 g·mol−1
Heat of Formation -1511.9 ± 16.7 kJ·mol−1
Dipole Moment 5.31 ± 1.08 D
Volume 329.1 Å 3
Surface Area 289.25 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]acetic acid
  • 2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]ethanoic acid
  • n-glycine-[3-hydroxy-2-methyl-5-phosphonooxymethyl-pyridin-4-yl-methane]
  • n-pyridoxyl-glycine-5-monophosphate
  • plg
InChIKey FEVQWBMNLWUBTF-UHFFFAOYSA-N
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