S-[2-(4-Azidophenyl)-2-Oxoethyl]-L-Cysteinyl-N-L-γ-Glutamylglycine

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Properties Simple | Detailed

Formula C18H23N6O7S
IUPAC Name (2s)-2-amino-5-[[(2r)-2-amino-3-[2-(4-azidophenyl)-2-oxo-ethyl]sulfanyl-propanoyl]-(carboxymethyl)amino]-5-oxo-pentanoic acid
Molecular Mass 467.476 g·mol−1
Heat of Formation -814.1 ± 16.7 kJ·mol−1
Dipole Moment 5.57 ± 1.08 D
Volume 527.5 Å 3
Surface Area 452.64 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -1.13 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-5-[[(2r)-2-amino-3-[2-(4-azidophenyl)-2-oxo-ethyl]sulfanyl-propanoyl]-(carboxymethyl)amino]-5-oxo-pentanoic acid
  • (2s)-2-amino-5-[[(2r)-2-amino-3-[2-(4-azidophenyl)-2-oxoethyl]sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid
  • (2s)-2-amino-5-[[(2r)-2-amino-3-[[2-(4-azidophenyl)-2-keto-ethyl]thio]propanoyl]-(carboxymethyl)amino]-5-keto-valeric acid
  • (2s)-2-amino-5-[[(2r)-2-amino-3-[[2-(4-azidophenyl)-2-oxoethyl]thio]-1-oxopropyl]-(carboxymethyl)amino]-5-oxopentanoic acid
  • apa-sg
  • glycine, n-(s-(2-(4-azidophenyl)-2-oxoethyl)-n-l-gamma-glutamyl-l-cysteinyl)-
  • spap-gsh
InChIKey JUILQQZYAXAGPV-STQMWFEESA-N
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