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CHEBI:83477 - terbutylazine-desethyl-2-hydroxy

ChEBI IDCHEBI:83477
ChEBI Nameterbutylazine-desethyl-2-hydroxy
Stars
DefinitionA diamino-1,3,5-triazine that is 1,3,5-triazin-2-ol substituted by an amino group at position 4 and a tert-butylamino group at position 6. It is metabolite of the herbicide terbutylazine.
Last Modified10 November 2014
DownloadsMolfile
FormulaC7H13N5O
Net Charge0
Average Mass183.215
Monoisotopic Mass183.11201
SMILESCC(C)(C)Nc1nc(N)nc(O)n1
InChIInChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)
InChIKeyNUISVCFZNCYUIM-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
marine xenobiotic metabolite  Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.
ChEBI Ontology
Outgoing Relation(s)
terbutylazine-desethyl-2-hydroxy (CHEBI:83477) has role marine xenobiotic metabolite (CHEBI:83399)
terbutylazine-desethyl-2-hydroxy (CHEBI:83477) is a diamino-1,3,5-triazine (CHEBI:38170)
terbutylazine-desethyl-2-hydroxy (CHEBI:83477) is a heteroaryl hydroxy compound (CHEBI:74818)
IUPAC Name 
4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol
Synonym  Source
desethyl-2-hydroxyterbuthylazineChEBI
Registry NumbersSources
Reaxys:7807198Reaxys