N-{[5-(2-Carboxyethyl)-3-Hydroxy-2-Methyl-4-Pyridinyl]Methyl}-L-Phenylalanine

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Properties Simple | Detailed

Formula C19H22N2O5
IUPAC Name (2r)-2-[[5-(2-carboxyethyl)-3-hydroxy-2-methyl-4-pyridyl]methylamino]-3-phenyl-propanoic acid
Molecular Mass 358.388 g·mol−1
Heat of Formation -816.1 ± 16.7 kJ·mol−1
Dipole Moment 2.78 ± 1.08 D
Volume 420.95 Å 3
Surface Area 362.96 Å 2
HOMO Energy -9.36 ± 0.55 eV
LUMO Energy 2.58 ± eV
Point Group Symmetry C1
InChIKey VNHORGDDSBQGPU-MRXNPFEDSA-N
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