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CHEBI:83448 - metribuzin-diketo

ChEBI IDCHEBI:83448
ChEBI Namemetribuzin-diketo
Stars
DefinitionA member of the class of 1,2,4-triazines that is 1,2,4-triazine-3,5(2H,4H)-dione substituted by an amino group at position 4 and a tert-butyl group at position 6. It is a metabolite of metribuzin.
Last Modified5 November 2014
DownloadsMolfile
FormulaC7H12N4O2
Net Charge0
Average Mass184.199
Monoisotopic Mass184.09603
SMILESCC(C)(C)c1nnc(=O)n(N)c1=O
InChIInChI=1S/C7H12N4O2/c1-7(2,3)4-5(12)11(8)6(13)10-9-4/h8H2,1-3H3,(H,10,13)
InChIKeyAHBXXEZLRFCZSF-UHFFFAOYSA-N
Roles Classification
Biological Role:
marine xenobiotic metabolite  Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.
ChEBI Ontology
Outgoing Relation(s)
metribuzin-diketo (CHEBI:83448) has role marine xenobiotic metabolite (CHEBI:83399)
metribuzin-diketo (CHEBI:83448) is a 1,2,4-triazines (CHEBI:39410)
metribuzin-diketo (CHEBI:83448) is a diketone (CHEBI:46640)
IUPAC Name 
4-amino-6-tert-butyl-1,2,4-triazine-3,5(2H,4H)-dione
Registry NumbersSources
Reaxys:4441906Reaxys
CAS:56507-37-0ChemIDplus
Citations