sulcotrione (CHEBI:83465)

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ChEBI Name	sulcotrione

ChEBI ID	CHEBI:83465

Definition	An aromatic ketone that is cyclohexane-1,3-dione substituted by a 2-chloro-4-(methylsulfonyl)benzoyl group at position 2.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C14H13ClO5S

Net Charge

Average Mass

328.76800

Monoisotopic Mass

328.01722

InChI

InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3

InChIKey

PQTBTIFWAXVEPB-UHFFFAOYSA-N

SMILES

CS(=O)(=O)c1ccc(C(=O)C2C(=O)CCCC2=O)c(Cl)c1

Roles Classification
Chemical Role(s):	environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects.

Biological Role(s):	carotenoid biosynthesis inhibitor Any pathway inhibitor that acts on the carotenoid biosynthesis pathway. 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.

ChEBI Ontology
Outgoing	sulcotrione (CHEBI:83465) has role carotenoid biosynthesis inhibitor (CHEBI:138208) sulcotrione (CHEBI:83465) has role environmental contaminant (CHEBI:78298) sulcotrione (CHEBI:83465) has role herbicide (CHEBI:24527) sulcotrione (CHEBI:83465) has role xenobiotic (CHEBI:35703) sulcotrione (CHEBI:83465) is a β-triketone (CHEBI:140323) sulcotrione (CHEBI:83465) is a aromatic ketone (CHEBI:76224) sulcotrione (CHEBI:83465) is a cyclohexanones (CHEBI:23482) sulcotrione (CHEBI:83465) is a sulfone (CHEBI:35850)

IUPAC Name

2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione

Last Modified

04 March 2018