N-Methyl-L-Valyl-N-[2-(4-Hydroxyphenyl)-1-Phosphonoethyl]-L-Tyrosinamide

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Formula C23H32N3O7P
IUPAC Name [(1s)-2-(4-hydroxyphenyl)-1-[[(2s)-3-(4-hydroxyphenyl)-2-[[(2s)-3-methyl-2-(methylamino)butanoyl]amino]propanoyl]amino]ethyl]phosphonic acid
Molecular Mass 493.490 g·mol−1
Heat of Formation -1427.7 ± 16.7 kJ·mol−1
Dipole Moment 2.63 ± 1.08 D
Volume 604.99 Å 3
Surface Area 467.19 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
InChIKey AFAFFSSNAUKMNO-ACRUOGEOSA-N
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