N-[(5S)-5-Amino-5-Carboxypentanoyl]-L-Cysteinyl-L-Valine

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Properties Simple | Detailed

Formula C14H25N3O6S
IUPAC Name (2s)-2-amino-6-[[(1r)-2-[[(1s)-1-carboxy-2-methyl-propyl]amino]-2-oxo-1-(sulfanylmethyl)ethyl]amino]-6-oxo-hexanoic acid
Molecular Mass 363.430 g·mol−1
Heat of Formation -1217.5 ± 16.7 kJ·mol−1
Dipole Moment 1.54 ± 1.08 D
Volume 437.75 Å 3
Surface Area 382.62 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-6-[[(1r)-2-[[(1s)-1-carboxy-2-methyl-propyl]amino]-2-keto-1-(mercaptomethyl)ethyl]amino]-6-keto-hexanoic acid
  • (2s)-2-amino-6-[[(1r)-2-[[(1s)-1-carboxy-2-methyl-propyl]amino]-2-oxo-1-(sulfanylmethyl)ethyl]amino]-6-oxo-hexanoic acid
  • (2s)-2-amino-6-[[(1r)-2-[[(1s)-1-carboxy-2-methylpropyl]amino]-1-(mercaptomethyl)-2-oxoethyl]amino]-6-oxohexanoic acid
  • (2s)-2-amino-6-[[(2r)-1-[[(2s)-1-hydroxy-3-methyl-1-oxo-butan-2-yl]amino]-1-oxo-3-sulfanyl-propan-2-yl]amino]-6-oxo-hexanoic acid
  • (2s)-2-amino-6-[[(2r)-1-[[(2s)-1-hydroxy-3-methyl-1-oxobutan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-6-oxohexanoic acid
  • (alpha-aminoadipyl)cysteinylvaline
  • (l-alpha-aminoadipyl)-l-cysteinyl-d-valine
  • 5-(2-aminoadipyl)-cysteinyl-valine
  • 5-(2-aminoadipyl)cysteinylvaline
  • d-valine, n-(n-(5-amino-5-carboxy-1-oxopentyl)-l-cysteinyl)-, (s)-
InChIKey BYEIJZFKOAXBBV-QXEWZRGKSA-N
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