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

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Properties Simple | Detailed

Formula C14H21N2O9P
IUPAC Name (2s)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]-2-methyl-pentanedioic acid
Molecular Mass 392.298 g·mol−1
Heat of Formation -1974.5 ± 16.7 kJ·mol−1
Dipole Moment 2.50 ± 1.08 D
Volume 432.05 Å 3
Surface Area 353.33 Å 2
HOMO Energy -9.30 ± 0.55 eV
LUMO Energy -0.73 ± eV
Point Group Symmetry C1
Synonyms
  • n-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)-2-methyl-l-glutamic acid
  • n-pyridoxyl-2-methyl-l-glutamic acid-5'-monophosphate
  • plp-gam
  • pmg
InChIKey CNIVMJHNGQZEAY-AWEZNQCLSA-N
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