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CHEBI:83463 - atrazine-desethyl-2-hydroxy

ChEBI IDCHEBI:83463
ChEBI Nameatrazine-desethyl-2-hydroxy
Stars
DefinitionA diamino-1,3,5-triazine that is N-(propan-2-yl)-1,3,5-triazine-2,4-diamine substituted by a hydroxy group at position 2. It is a metabolite of the herbicide atrazine.
Last Modified10 November 2014
DownloadsMolfile
FormulaC6H11N5O
Net Charge0
Average Mass169.188
Monoisotopic Mass169.09636
SMILESCC(C)Nc1nc(N)nc(O)n1
InChIInChI=1S/C6H11N5O/c1-3(2)8-5-9-4(7)10-6(12)11-5/h3H,1-2H3,(H4,7,8,9,10,11,12)
InChIKeyGCKLGRUZDXSATG-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)
atrazine-desethyl-2-hydroxy (CHEBI:83463) has role marine xenobiotic metabolite (CHEBI:83399)
atrazine-desethyl-2-hydroxy (CHEBI:83463) is a diamino-1,3,5-triazine (CHEBI:38170)
atrazine-desethyl-2-hydroxy (CHEBI:83463) is a heteroaryl hydroxy compound (CHEBI:74818)
IUPAC Name 
4-amino-6-(propan-2-ylamino)-1,3,5-triazin-2-ol
Registry NumbersSources
Reaxys:7759517Reaxys
Citations