L-γ-Glutamyl-S-(3-Bromo-2,5-Dihydroxyphenyl)-L-Cysteinylglycine

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Properties Simple | Detailed

Formula C16H20BrN3O8S
IUPAC Name (2s)-2-amino-5-[[(1r)-1-[(3-bromo-2,5-dihydroxy-phenyl)sulfanylmethyl]-2-(carboxymethylamino)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
Molecular Mass 494.314 g·mol−1
Heat of Formation -1385.8 ± 16.7 kJ·mol−1
Dipole Moment 1.54 ± 1.08 D
Volume 495.79 Å 3
Surface Area 385.65 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-5-[[(1r)-1-[(3-bromo-2,5-dihydroxy-phenyl)sulfanylmethyl]-2-(carboxymethylamino)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
  • (2s)-2-amino-5-[[(1r)-1-[[(3-bromo-2,5-dihydroxy-phenyl)thio]methyl]-2-(carboxymethylamino)-2-keto-ethyl]amino]-5-keto-valeric acid
  • (2s)-2-amino-5-[[(1r)-1-[[(3-bromo-2,5-dihydroxyphenyl)thio]methyl]-2-(carboxymethylamino)-2-oxoethyl]amino]-5-oxopentanoic acid
  • (2s)-2-amino-5-[[(2r)-3-(3-bromo-2,5-dihydroxy-phenyl)sulfanyl-1-(carboxymethylamino)-1-oxo-propan-2-yl]amino]-5-oxo-pentanoic acid
  • 2-br-6-(gsyl)hq
  • 2-bromo-6-(glutathion-s-yl)hydroquinone
  • 2-bromo-6-(monoglutathion-s-yl)hydroquinone
  • glycine, l-gamma-glutamyl-s-(3-bromo-2,5-dihydroxyphenyl)-l-cysteinyl-
  • glycine, n-(5-(3-bromo-2,5-dihydroxyphenyl)-n-l-gamma-glutamyl-l-cysteinyl)-
  • n-(5-(3-bromo-2,5-dihydroxyphenyl)-n-l-gamma-glutamyl-l-cysteinyl)glycine
CAS Number(s)
  • 114865-64-4
InChIKey QSJZDQPQNVINPC-UWVGGRQHSA-N
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