N-[(2E)-3-(2-Furyl)-2-Propenoyl]-D-Phenylalanylglycylglycine

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Properties Simple | Detailed

Formula C20H21N3O6
IUPAC Name 2-[[2-[[(2r)-2-[[(e)-3-(2-furyl)prop-2-enoyl]amino]-3-phenyl-propanoyl]amino]acetyl]amino]acetic acid
Molecular Mass 399.397 g·mol−1
Heat of Formation -781.1 ± 16.7 kJ·mol−1
Dipole Moment 1.53 ± 1.08 D
Volume 473.67 Å 3
Surface Area 425.93 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[2-[[(2r)-2-[[(e)-3-furan-2-ylprop-2-enoyl]amino]-3-phenyl-propanoyl]amino]ethanoylamino]ethanoic acid
  • 2-[[2-[[(2r)-2-[[(e)-3-(2-furyl)-1-oxoprop-2-enyl]amino]-1-oxo-3-phenylpropyl]amino]-1-oxoethyl]amino]acetic acid
  • 2-[[2-[[(2r)-2-[[(e)-3-(2-furyl)acryloyl]amino]-3-phenyl-propanoyl]amino]acetyl]amino]acetic acid
  • 2-[[2-[[(2r)-2-[[(e)-3-(2-furyl)prop-2-enoyl]amino]-3-phenyl-propanoyl]amino]acetyl]amino]acetic acid
  • 2-[[2-[[(2r)-2-[[(e)-3-furan-2-ylprop-2-enoyl]amino]-3-phenylpropanoyl]amino]acetyl]amino]acetic acid
InChIKey ZDLZKMDMBBMJLI-ROJDOSBLSA-N
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