O-[2-(5-Methyl-2-Phenyl-1,3-Oxazol-4-Yl)Ethyl]-N-(4-Oxo-4-Phenyl-2-Butanyl)-L-Tyrosine

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Properties Simple | Detailed

Formula C31H33N2O5
IUPAC Name (2s)-2-[[(1s)-1-methyl-3-oxo-3-phenyl-propyl]amino]-3-[4-[2-(5-methyl-2-phenyl-oxazol-3-ium-5-id-4-yl)ethoxy]phenyl]propanoic acid
Molecular Mass 513.604 g·mol−1
Heat of Formation -481.6 ± 16.7 kJ·mol−1
Dipole Moment 2.73 ± 1.08 D
Volume 622.38 Å 3
Surface Area 551.62 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy -0.65 ± eV
Point Group Symmetry C1
InChIKey HJCQEONSDMSVQK-PIKZIKFNSA-N
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