L-γ-Glutamyl-S-[2,5-Dihydroxy-4-(2-Methyl-2-Propanyl)Phenyl]-L-Cysteinylglycine

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Properties Simple | Detailed

Formula C20H29N3O8S
IUPAC Name (2s)-2-amino-5-[[(1r)-1-[(4-tert-butyl-2,5-dihydroxy-phenyl)sulfanylmethyl]-2-(carboxymethylamino)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
Molecular Mass 471.525 g·mol−1
Heat of Formation -1500.9 ± 16.7 kJ·mol−1
Dipole Moment 5.07 ± 1.08 D
Volume 558.14 Å 3
Surface Area 429.48 Å 2
HOMO Energy -8.64 ± 0.55 eV
LUMO Energy -0.72 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-5-[[(1r)-1-[(4-tert-butyl-2,5-dihydroxy-phenyl)sulfanylmethyl]-2-(carboxymethylamino)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
  • (2s)-2-amino-5-[[(1r)-1-[[(4-tert-butyl-2,5-dihydroxy-phenyl)thio]methyl]-2-(carboxymethylamino)-2-keto-ethyl]amino]-5-keto-valeric acid
  • (2s)-2-amino-5-[[(1r)-1-[[(4-tert-butyl-2,5-dihydroxyphenyl)thio]methyl]-2-(carboxymethylamino)-2-oxoethyl]amino]-5-oxopentanoic acid
  • (2s)-2-amino-5-[[(2r)-3-(4-tert-butyl-2,5-dihydroxy-phenyl)sulfanyl-1-(carboxymethylamino)-1-oxo-propan-2-yl]amino]-5-oxo-pentanoic acid
  • 5-(s-glutathionyl)-2-tert-butylhydroquinone
  • 5gs-tbhq conjugate
  • glycine, n-(5-(4-(1,1-dimethylethyl)-2,5-dihydroxyphenyl)-n-l-gamma-glutamyl-l-cysteinyl)-
  • n-(5-(4-(1,1-dimethylethyl)-2,5-dihydroxyphenyl)-n-l-gamma-glutamyl-l-cysteinyl)glycine
CAS Number(s)
  • 139035-70-4
InChIKey ZOFLHFUJRPXAAO-RYUDHWBXSA-N
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