L-γ-Glutamyl-S-(2-Amino-5-Hydroxyphenyl)-L-Cysteinylglycine

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Properties Simple | Detailed

Formula C16H22N4O7S
IUPAC Name (2s)-2-amino-5-[[(1r)-1-[(2-amino-5-hydroxy-phenyl)sulfanylmethyl]-2-(carboxymethylamino)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
Molecular Mass 414.433 g·mol−1
Heat of Formation -1237.5 ± 16.7 kJ·mol−1
Dipole Moment 1.64 ± 1.08 D
Volume 478.86 Å 3
Surface Area 375.88 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-5-[[(1r)-1-[(2-amino-5-hydroxy-phenyl)sulfanylmethyl]-2-(carboxymethylamino)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
  • (2s)-2-amino-5-[[(1r)-1-[[(2-amino-5-hydroxy-phenyl)thio]methyl]-2-(carboxymethylamino)-2-keto-ethyl]amino]-5-keto-valeric acid
  • (2s)-2-amino-5-[[(1r)-1-[[(2-amino-5-hydroxyphenyl)thio]methyl]-2-(carboxymethylamino)-2-oxoethyl]amino]-5-oxopentanoic acid
  • (2s)-2-amino-5-[[(2r)-3-(2-amino-5-hydroxy-phenyl)sulfanyl-1-(carboxymethylamino)-1-oxo-propan-2-yl]amino]-5-oxo-pentanoic acid
  • 4-agtp
  • 4-amino-3-s-glutathionylphenol
  • glycine, n-(s-(2-amino-5-hydroxyphenyl)-n-l-gamma-glutamyl-l-cysteinyl)-
  • n-(s-(2-amino-5-hydroxyphenyl)-n-l-gamma-glutamyl-l-cysteinyl)glycine
CAS Number(s)
  • 129762-74-9
InChIKey GWRHLCBVVARMDR-QWRGUYRKSA-N
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