Isoproturon (BioCAD00000012657)

blood

Metabolite Card

Formula: C12H18N2O (206.1419)
SMILES: CC(C)C1=CC=C(NC(=O)N(C)C)C=C1

Synonyms [en]

isoproturon; 1,1-dimethyl-3-[4-(propan-2-yl)phenyl]urea; N-4-Isopropylphenyl-N,N-dimethylurea; 3-p-Cumenyl-1,1-dimethylurea; 1,1-dimethyl-3-(p-isopropylphenyl)-urea; 3-(4-isopropylphenyl)-1,1-dimethyl-urea

Reviewed

Last reviewed on 2024-06-28.

Cite this Page

Isoproturon. 数据之源，洞见之始. SMRUCC genomics institute, a synthetic life researcher from China. https://biocad_registry.innovation.ac.cn/s/(-)-arctiin (retrieved 2026-01-03) (CAD Registry RN: BioCAD00000012657). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Note

A member of the class of phenylureas that is 1,1-dimethylurea substituted by a p-cumenyl group at position 3. A selective, systemic herbicide used to control annual grasses and broadleaf weeds in cereals, its use within the EU has been banned after September 2017 on the grounds of potential groundwater contamination and risks to aquatic life; there have also been concerns about its endocrine-disrupting properties." []

Entity Information

DBLinks

Other DBLinks
  • CAS Registry Number: 34123-59-6
  • PubChem: 36679
  • ChEBI: ChEBI:6049
  • HMDB: HMDB0253682
  • KEGG: C11005
  • BioCyc: CPD-23253
  • NCBI MeSH: isoproturon
  • RefMet: RM0188434
  • MoNA: AU351801
  • MoNA: AU351802
  • MoNA: AU351803
  • MoNA: AU351804
  • MoNA: AU351805
  • MoNA: AU351806
  • MoNA: EA028601
  • MoNA: EA028602
  • MoNA: EA028603
  • MoNA: EA028604
  • MoNA: EA028605
  • MoNA: EA028606
  • MoNA: EA028607
  • MoNA: EA028608
  • MoNA: EA028609
  • MoNA: EA028610
  • MoNA: EA028611
  • MoNA: EA028612
  • MoNA: EA028613
  • MoNA: EA028614
  • MoNA: LU003301
  • MoNA: LU003302
  • MoNA: LU003303
  • MoNA: LU003304
  • MoNA: LU003305
  • MoNA: LU003306
  • MoNA: MSJ01094
  • MoNA: SM838102
  • MoNA: UF400501
  • MoNA: UF400502
  • MoNA: UF400503
  • MoNA: UF400504
  • Metlin: METLIN_68764
  • Coconut NaturalProduct: CNP0068061.0

Class / Ontology

Metabolic Network
ID EC Number Name
Rhea:RHEA:65773 isoproturon + 2 reduced [2Fe-2S]-[ferredoxin] + O2 + 2 H+ => 1-methyl-3-[4-(propan-2-yl)phenyl]urea + formaldehyde + 2 oxidized [2Fe-2S]-[ferredoxin] + H2O
Rhea:RHEA:65774 1-methyl-3-[4-(propan-2-yl)phenyl]urea + formaldehyde + 2 oxidized [2Fe-2S]-[ferredoxin] + H2O => isoproturon + 2 reduced [2Fe-2S]-[ferredoxin] + O2 + 2 H+
Rhea:RHEA:65775 isoproturon + 2 reduced [2Fe-2S]-[ferredoxin] + O2 + 2 H+ <=> 1-methyl-3-[4-(propan-2-yl)phenyl]urea + formaldehyde + 2 oxidized [2Fe-2S]-[ferredoxin] + H2O
BioCyc:RXN-21352 3.5.1.- CPD-23253 + WATER + PROTON --> DIMETHYLAMINE + CARBON-DIOXIDE + CPD-23267
BioCyc:RXN-21354 1.14.15.38 CPD-23253 + 2 Reduced-ferredoxins + OXYGEN-MOLECULE + 2 PROTON --> CPD-23265 + FORMALDEHYDE + 2 Oxidized-ferredoxins + WATER
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Organism Source

Taxonomy Source

Pathway Synthetic

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