N-[(2Z)-2-Acetamido-3-(2-Furyl)-2-Propenoyl]-L-Tyrosine

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Formula C18H18N2O6
IUPAC Name (2s)-2-[[(z)-2-acetamido-3-(2-furyl)prop-2-enoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
Molecular Mass 358.345 g·mol−1
Heat of Formation -828.9 ± 16.7 kJ·mol−1
Dipole Moment 7.25 ± 1.08 D
Volume 418.66 Å 3
Surface Area 352.42 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(z)-2-acetamido-3-(2-furyl)-1-oxoprop-2-enyl]amino]-3-(4-hydroxyphenyl)propanoic acid
  • (2s)-2-[[(z)-2-acetamido-3-(2-furyl)acryloyl]amino]-3-(4-hydroxyphenyl)propionic acid
  • (2s)-2-[[(z)-2-acetamido-3-(2-furyl)prop-2-enoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
  • (2s)-2-[[(z)-2-acetamido-3-furan-2-yl-prop-2-enoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
  • (2s)-2-[[(z)-2-acetamido-3-furan-2-ylprop-2-enoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
  • acetyldehydro-3-(2-furyl)-ala-tyr
  • acetyldehydro-3-(2-furyl)alanyltyrosine
  • l-tyrosine, n-(n-acetyl-2,3-didehydro-3-(2-furanyl)alanyl)-
CAS Number(s)
  • 68762-71-0
InChIKey OGHKTSXTGWMYFE-IZNAZMGOSA-N
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