Chem
J-GLOBAL ID：201007032883505433   Nikkaji number：J2.789.620K

2-(S-Glutathionyl)acetyl chloride

2-(S-グルタチオニル)アセチルクロリド
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C12H18ClN3O7S
Molecular formula furigana： C12-H18-CL-N3-O7-S
Molecular weight： 383.800
InChI： InChI=1S/C12H18ClN3O7S/c13-8(17)5-24-4-7(11(21)15-3-10(19)20)16-9(18)2-1-6(14)12(22)23/h6-7H,1-5,14H2,(H,15,21)(H,16,18)(H,19,20)(H,22,23)/t6-,7-/m0/s1
InChI key： QUWRSBQWJGCKIV-BQBZGAKWSA-N
SMILES： N[C@@H](CCC(=O)N[C@@H](CSCC(=O)Cl)C(=O)NCC(=O)O)C(=O)O
Systematic name  (3)：
  • L-γGlu-S-(2-クロロ-2-オキソエチル)-L-Cys-Gly-OH
  • (2S)-2-アミノ-4-{[(1R)-1-[(カルボキシメチル)カルバモイル]-2-[(2-クロロ-2-オキソエチル)スルファニル]エチル]カルバモイル}ブタン酸
  • (2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)carbamoyl]-2-[(2-chloro-2-oxoethyl)sulfanyl]ethyl]carbamoyl}butanoic acid
Other name (3)：
  • L-γGlu-S-(2-Chloro-2-oxoethyl)-L-Cys-Gly-OH
  • 2-(S-Glutathionyl)acetyl chloride
  • 2-(S-グルタチオニル)アセチルクロリド
KEGG COMPOUND： C14865
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