Sulfometuron-methyl

Bensulfuron-methyl. An acetolactate synthase inhibitor, it is used as a herbicide for the control of a variety of both annual and perennial weeds in crops, particularly wheat and rice. It is not licensed for use within the UK. Hydrolyzed by SulE, a sulfonylurea herbicide de-esterification esterase from Hansschlegelia zhihuaiae S113

General

Type : Herbicide, Sulfonamide, Sulfur Compound, Carboxamide, Urea derivative, Pyrimidine

Chemical_Nomenclature : methyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]benzoate

Canonical SMILES : CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)C

InChI : InChI=1S\/C15H16N4O5S\/c1-9-8-10(2)17-14(16-9)18-15(21)19-25(22,23)12-7-5-4-6-11(12)13(20)24-3\/h4-8H,1-3H3,(H2,16,17,18,19,21)

InChIKey : ZDXMLEQEMNLCQG-UHFFFAOYSA-N

Other name(s) : sulfometuron methyl  ||  1SM  ||  OUST  ||  DPX-T5648  ||  CHEBI:9348  ||  SCHEMBL54998  ||  CHEMBL513261


MW : 364.4

Formula : C15H16N4O5S

CAS_number : 74222-97-2

PubChem : 52997

UniChem : ZDXMLEQEMNLCQG-UHFFFAOYSA-N

Target

Structures : 8J7I, 8IW6

Families : Bacterial_esterase

References (1)

Title : Crystal structures of herbicide-detoxifying esterase reveal a lid loop affecting substrate binding and activity - Liu_2023_Nat.Commun_14_4343
Author(s) : Liu B , Wang W , Qiu J , Huang X , Qiu S , Bao Y , Xu S , Ruan L , Ran T , He J
Ref : Nat Commun , 14 :4343 , 2023
Abstract :
PubMedSearch : Liu_2023_Nat.Commun_14_4343
PubMedID: 37468532
Gene_locus related to this paper: 9rhiz-g9i933