(2S)-2-[({3-Hydroxy-2-Methyl-5-[(Phosphonooxy)Methyl]-4-Pyridinyl}Methyl)Amino]Hexanedioic Acid

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Formula C14H21N2O9P
IUPAC Name (2s)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]hexanedioic acid
Molecular Mass 392.298 g·mol−1
Heat of Formation -1991.0 ± 16.7 kJ·mol−1
Dipole Moment 6.30 ± 1.08 D
Volume 426.66 Å 3
Surface Area 349.74 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
InChIKey VAICOQQXLDOKQG-NSHDSACASA-N
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