CHEBI:83447 - metamitron-desamino

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ChEBI Name metamitron-desamino
ChEBI ID CHEBI:83447
Definition A member of the class of 1,2,4-triazines that is metamitron in which the amino group has been replaced by a hydrogen atom. It is a metabolite of metamitron.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C10H9N3O
Net Charge 0
Average Mass 187.19800
Monoisotopic Mass 187.07456
InChI InChI=1S/C10H9N3O/c1-7-11-10(14)9(13-12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,11,12,14)
InChIKey OUSYWCQYMPDAEO-UHFFFAOYSA-N
SMILES Cc1nnc(-c2ccccc2)c(=O)[nH]1
Roles Classification
Biological Role(s): marine xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing metamitron-desamino (CHEBI:83447) has functional parent metamitron (CHEBI:6791)
metamitron-desamino (CHEBI:83447) has role marine xenobiotic metabolite (CHEBI:83399)
metamitron-desamino (CHEBI:83447) is a 1,2,4-triazines (CHEBI:39410)
IUPAC Name
3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one
Synonym Source
deaminometamitron ChEBI
Registry Numbers Types Sources
36993-94-9 CAS Registry Number ChemIDplus
514474 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
13129305 PubMed citation Europe PMC
16484082 PubMed citation Europe PMC
22047469 PubMed citation Europe PMC
Last Modified
04 November 2014
General Comments
2014-10-29 Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag
2014-10-29 Metabolite of Metamitron
2014-10-29 Suggested Classification: ISA:benzenes(CHEBI:22712); ISA:lactam(CHEBI:24995); ISA:organonitrogen compound(CHEBI:35352);