Chem
J-GLOBAL ID:200907027326188188   Nikkaji number:J371.899I

S-(4-Trifluoromethyl-2-nitrophenyl)glutathione

S-(4-トリフルオロメチル-2-ニトロフェニル)グルタチオン
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: C17H19F3N3[N+]O7[O-]S
Molecular formula furigana: C17-H19-F3-N4-O8-S
Molecular weight: 496.410
InChI: InChI=1S/C17H19F3N4O8S/c18-17(19,20)8-1-3-12(11(5-8)24(31)32)33-7-10(15(28)22-6-14(26)27)23-13(25)4-2-9(21)16(29)30/h1,3,5,9-10H,2,4,6-7,21H2,(H,22,28)(H,23,25)(H,26,27)(H,29,30)/t9-,10-/m0/s1
InChI key: LVQLIYZNSWYMOJ-UWVGGRQHSA-N
SMILES: N[C@@H](CCC(=O)N[C@@H](CSc1ccc(cc1[N+](=O)[O-])C(F)(F)F)C(=O)NCC(=O)O)C(=O)O
Systematic name  (4):
  • L-γGlu-S-[2-ニトロ-4-(トリフルオロメチル)フェニル]-L-Cys-Gly-OH
  • L-γGlu-S-[4-(トリフルオロメチル)-2-ニトロフェニル]-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-ニトロ-4-(トリフルオロメチル)フェニル]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-nitro-4-(trifluoromethyl)phenyl]sulfanyl}ethyl]carbamoyl}butanoic acid
Other name (3):
  • S-(4-Trifluoromethyl-2-nitrophenyl)glutathione
  • S-(4-トリフルオロメチル-2-ニトロフェニル)グルタチオン
  • L-γGlu-S-[4-(Trifluoromethyl)-2-nitrophenyl]-L-Cys-Gly-OH
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