2-Hydroxy-5-{[(2Z)-1-(4-Methylphenoxy)-4-Oxo-2-Buten-2-Yl]Amino}-L-Tyrosine

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Properties Simple | Detailed

Formula C20H22N2O6
IUPAC Name (2s)-2-amino-3-[2,4-dihydroxy-5-[[(e)-1-[(4-methylphenoxy)methyl]-3-oxo-prop-1-enyl]amino]phenyl]propanoic acid
Molecular Mass 386.398 g·mol−1
Heat of Formation -837.8 ± 16.7 kJ·mol−1
Dipole Moment 7.78 ± 1.08 D
Volume 455.58 Å 3
Surface Area 390.61 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy 2.53 ± eV
Point Group Symmetry C1
InChIKey FSNBWEOGSXUNGF-CQMBDMNQSA-N
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