Chemical Compound

Atrazine Glutathione Conjugate-CoA; (Acyl-CoA); [M+H]+;

Atrazine Glutathione Conjugate-CoA; (Acyl-CoA); [M+H]+; chemical structure
Primary Record

Atrazine Glutathione Conjugate-CoA; (Acyl-CoA); [M+H]+;

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
155489224
SMILES
CCNC1=NC(=NC(=N1)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O)O)O)N)NC(C)C
Canonical SMILES
CCNc1nc(NC(C)C)nc(SCC(NC(=O)CCC(N)C(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2OP(=O)(O)O)C(=O)NCC(=O)O)n1

Names & Synonyms

  • Atrazine Glutathione Conjugate-CoA; (Acyl-CoA); [M+H]+;