Hippuryl-L-Histidyl-L-Leucine

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Properties Simple | Detailed

Formula C21H27N5O5
IUPAC Name (2s)-2-[[(2s)-2-[(2-benzamidoacetyl)amino]-3-(1h-imidazol-5-yl)propanoyl]amino]-4-methyl-pentanoic acid
Molecular Mass 429.470 g·mol−1
Heat of Formation -779.8 ± 16.7 kJ·mol−1
Dipole Moment 1.89 ± 1.08 D
Volume 523.73 Å 3
Surface Area 442.5 Å 2
HOMO Energy -9.55 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2s)-2-[[2-(benzoylamino)acetyl]amino]-3-(3h-imidazol-4-yl)propanoyl]amino]-4-methyl-pentanoic acid
  • (2s)-2-[[(2s)-2-[[2-(benzoylamino)acetyl]amino]-3-(3h-imidazol-4-yl)propanoyl]amino]-4-methyl-valeric acid
  • (2s)-2-[[(2s)-2-[[2-(benzoylamino)acetyl]amino]-3-(3h-imidazol-4-yl)propanoyl]amino]-4-methylpentanoic acid
  • (2s)-2-[[(2s)-3-(3h-imidazol-4-yl)-1-oxo-2-[[1-oxo-2-[(oxo-phenylmethyl)amino]ethyl]amino]propyl]amino]-4-methylpentanoic acid
  • (2s)-2-[[(2s)-3-(3h-imidazol-4-yl)-2-[2-(phenylcarbonylamino)ethanoylamino]propanoyl]amino]-4-methyl-pentanoic acid
  • hippuryl-histidyl-leucine
InChIKey AAXWBCKQYLBQKY-IRXDYDNUSA-N
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