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CHEBI:40955 - ATRAZINE GLUTATHIONE CONJUGATE

Default Structure
ChEBI IDCHEBI:40955
ChEBI NameATRAZINE GLUTATHIONE CONJUGATE
Stars
DownloadsMolfile
FormulaC18H30N8O6S
Net Charge0
Average Mass486.555
Monoisotopic Mass486.20090
SMILES[H]OC(=O)C([H])([H])N([H])C(=O)[C@@]([H])(N([H])C(=O)C([H])([H])C([H])([H])[C@@]([H])(C(=O)O[H])N([H])[H])C([H])([H])Sc1nc(N([H])C([H])([H])C([H])([H])[H])nc(N([H])C([H])(C([H])([H])[H])C([H])([H])[H])n1
InChIInChI=1S/C18H30N8O6S/c1-4-20-16-24-17(22-9(2)3)26-18(25-16)33-8-11(14(30)21-7-13(28)29)23-12(27)6-5-10(19)15(31)32/h9-11H,4-8,19H2,1-3H3,(H,21,30)(H,23,27)(H,28,29)(H,31,32)(H2,20,22,24,25,26)/t10-,11-/m0/s1
InChIKeyWDLCRTLULMGVMR-QWRGUYRKSA-N
ChEBI Ontology
Outgoing Relation(s)
ATRAZINE GLUTATHIONE CONJUGATE (CHEBI:40955) is a unclassifieds (CHEBI:27189)
Synonyms  Source
ATRAZINE GLUTATHIONE CONJUGATEPDBeChem
L-gamma-glutamyl-S-{4-(ethylamino)-6-[(1-methylethyl)amino]-1,3,5-triazin-2-yl}-L-cysteinylglycinePDBeChem
Manual XrefsDatabases
ATAPDBeChem