CHEBI:6791 - metamitron

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ChEBI Name metamitron
ChEBI ID CHEBI:6791
Definition A member of the class of 1,2,4-triazines that is 1,2,4-triazin-5(4H)-one substituted by an amino group at position 4, a methyl group at position 3 and a phenyl group at position 6.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB2724915, eMolecules:509860, ZINC000000097471
Download Molfile XML SDF
Formula C10H10N4O
Net Charge 0
Average Mass 202.21260
Monoisotopic Mass 202.08546
InChI InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3
InChIKey VHCNQEUWZYOAEV-UHFFFAOYSA-N
SMILES Cc1nnc(-c2ccccc2)c(=O)n1N
Roles Classification
Chemical Role(s): environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role(s): xenobiotic
A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
Application(s): herbicide
A substance used to destroy plant pests.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing metamitron (CHEBI:6791) has role environmental contaminant (CHEBI:78298)
metamitron (CHEBI:6791) has role herbicide (CHEBI:24527)
metamitron (CHEBI:6791) has role xenobiotic (CHEBI:35703)
metamitron (CHEBI:6791) is a 1,2,4-triazines (CHEBI:39410)
Incoming metamitron-desamino (CHEBI:83447) has functional parent metamitron (CHEBI:6791)
IUPAC Name
4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one
Synonym Source
Goltix KEGG COMPOUND
Manual Xrefs Databases
448 PPDB
C10930 KEGG COMPOUND
metamitron Alan Wood's Pesticides
View more database links
Registry Numbers Types Sources
41394-05-2 CAS Registry Number ChemIDplus
613129 Reaxys Registry Number Reaxys
Citations Types Sources
23135307 PubMed citation Europe PMC
24240634 PubMed citation Europe PMC
Last Modified
04 November 2014
General Comment
2014-10-29 Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag