(2S)-2-[3-(Aminomethyl)Phenyl]-3-{Hydroxy[(1R)-2-Methyl-1-{[(2-Phenylethyl)Sulfonyl]Amino}Propyl]Phosphoryl}Propanoic Acid

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Formula C22H31N2O6PS
IUPAC Name (2s)-2-[3-(aminomethyl)phenyl]-3-[hydroxy-[(1r)-2-methyl-1-(2-phenylethylsulfonylamino)propyl]phosphoryl]propanoic acid
Molecular Mass 482.530 g·mol−1
Heat of Formation -1156.5 ± 16.7 kJ·mol−1
Dipole Moment 4.38 ± 1.08 D
Volume 574.6 Å 3
Surface Area 471.85 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
InChIKey CTQDLSDUHUFBQW-LEWJYISDSA-N
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