L-γ-Glutamyl-S-[(E)-1,2-Dichlorovinyl]-L-Cysteinylglycine

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Properties Simple | Detailed

Formula C12H17Cl2N3O6S
IUPAC Name (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[(e)-1,2-dichlorovinyl]sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
Molecular Mass 402.251 g·mol−1
Heat of Formation -1107.2 ± 16.7 kJ·mol−1
Dipole Moment 1.46 ± 1.08 D
Volume 432.85 Å 3
Surface Area 367.87 Å 2
HOMO Energy -9.25 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[(e)-1,2-dichlorovinyl]sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
  • (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[[(e)-1,2-dichlorovinyl]thio]methyl]-2-keto-ethyl]amino]-5-keto-valeric acid
  • (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[[(e)-1,2-dichlorovinyl]thio]methyl]-2-oxoethyl]amino]-5-oxopentanoic acid
  • (2s)-2-amino-5-[[(2r)-1-(carboxymethylamino)-3-[(e)-1,2-dichloroethenyl]sulfanyl-1-oxo-propan-2-yl]amino]-5-oxo-pentanoic acid
  • (e)-n-(s-(1,2-dichloroethenyl)-n-l-gamma-glutamyl-l-cysteinyl)glycine
  • (e)-s-(1,2-dichlorovinyl)glutathione
  • dcvg
  • glycine, n-(s-(1,2-dichloroethenyl)-n-l-gamma-glutamyl-l-cysteinyl)-, (e)-
  • s-(1,2-dichlorovinyl)glutathione
CAS Number(s)
  • 96614-59-4
InChIKey IXARYIJEQUJTIZ-KWRIXSAHSA-N
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