permethrin

Identification (Source:EPA,EU)

ID 276
Name permethrin
CAS 52645-53-1
IUPAC
Inchi InChI=1S/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-7-6-10-16(11-14)26-15-8-4-3-5-9-15/h3-12,17,19H,13H2,1-2H3
CIPAC 331
EPA Code 109701
Formula C21H20Cl2O3
SMILES c3ccccc3Oc(c2)cccc2COC(=O)C1C(C1(C)C)C=C(Cl)Cl
Status Approved

Classification

Mode of Action Broad spectrum with contact and stomach action. Slight repellant effect. Sodium channel modulator.
Pesticide Type Insecticide, Veterinary treatment
Chemical Group Pyrethroid
Classification pyrethroid ester insecticides
pyrethroid ester acaricides

Properties (Source:PubChem)

Molecular Weight 391.3
Physical State Colourless crystalline solid to brown viscous liquid depending upon purity
AlogP 5.438
H-Bond Donor 0
H-Bond Acceptor 3
Surface Area 363.87
Polar Surface Area 35.53

Structure



ChemMapper Search Option (Docunmentation of ChemMapper)

3D similarity method

2D similarity method

Compound Database



Bioactivity Database

KEGG (5,928)

PDB (7,072)


Similarity Threshold

Ecotoxicology (Source:PPDB,IPM)

Species Method Study Time Dose Type Value
Algae Chronic 96 hour NOEC, growth 0.0009 mg l-1
Algae Acute 72 hour EC50, growth 0.0125 mg l-1
Aquatic crustaceans Acute 96 hour LC50 0.00002 mg l-1
Aquatic invertebrates Acute 48 hour EC50 0.0006 mg l-1
Birds Acute LD50 > 9800 mg kg-1
Earthworms Acute 14 day LD50 1440 mg kg-1
Fish Chronic 21 day NOEC 0.00012 mg l-1
Fish Acute 96 hour LC50 0.0125 mg l-1
Honeybees Acute 48 hour LD50 0.029 μg bee-1
Mammals Acute oral LD50 > 430 mg kg-1
Mammals Short term dietary NOEL 100 ppm diet
Sediment dwelling organisms Acute 96 hour LC50 0.0029 mg l-1
Bio-concentration factor CT50 Not available days
Bio-concentration factor BCF 300

Related targets

Target Name RScore (About this table)
ATPase 638(6,10,12,28) Details
cytochrome P450 (protein family or complex) 427(3,6,15,52) Details
Acetylcholinesterase 422(3,6,15,47) Details
cytochrome P450 monooxygenases 323(3,5,7,13) Details
Cl 2 253(3,3,3,13) Details
androgen receptor 251(3,3,3,11) Details
M2 muscarinic acetylcholine receptor 194(2,3,3,4) Details
sodium channel (protein family or complex) 440(1,5,33,100) Details
estrogen receptor alpha 180(1,4,4,10) Details
c fos 169(1,3,6,14) Details
calmodulin 166(1,3,5,16) Details
CYP3A4 162(1,3,4,17) Details
cholinesterase 155(1,3,3,15) Details
hCE 2 118(1,2,2,8) Details
P450scc 112(1,2,2,2) Details
steroidogenic acute regulatory protein 112(1,2,2,2) Details
benzodiazepine receptor (protein family or complex) 112(1,2,2,2) Details
adenylate cyclase 91(1,1,2,6) Details
phosphodiesterase 91(1,1,2,6) Details
acetylcholine receptor (protein family or complex) 88(1,1,2,3) Details
CYP2B6 87(1,1,1,7) Details
ornithine decarboxylase 87(1,1,2,2) Details
monoamine oxidase A 85(1,1,1,5) Details
complex I 85(1,1,1,5) Details
CYP1A1 84(1,1,1,4) Details
calcineurin (protein family or complex) 84(1,1,1,4) Details
alkaline phosphatase 84(1,1,1,4) Details
PC3 84(1,1,1,4) Details
lactate dehydrogenase (protein family or complex) 83(1,1,1,3) Details
MEST 83(1,1,1,3) Details
MAPK (protein family or complex) 82(1,1,1,2) Details
CYP2D 81(1,1,1,1) Details
myeloperoxidase 81(1,1,1,1) Details
succinate dehydrogenase (protein family or complex) 81(1,1,1,1) Details
CYP3A5 81(1,1,1,1) Details
CYP2A6 81(1,1,1,1) Details
cis 1 81(1,1,1,1) Details
glutathione S transferase 139(0,3,6,34) Details
brain derived neurotrophic factor 109(0,3,5,9) Details
HCE1 75(0,2,3,10) Details
cytochrome c 65(0,1,5,15) Details
dopamine transporter 50(0,1,3,10) Details
IL 8 42(0,1,2,7) Details
cis 3 37(0,1,1,7) Details
ErbB 2 34(0,1,1,4) Details
CA1 34(0,1,1,4) Details
Camk1g 33(0,1,1,3) Details
GABAT 33(0,1,1,3) Details
epidermal growth factor 33(0,1,1,3) Details
microtubule associated protein 2 32(0,1,1,2) Details
net 1 32(0,1,1,2) Details
choline acetylase 32(0,1,1,2) Details
AP 1 (protein family or complex) 31(0,1,1,1) Details
PC 3 31(0,1,1,1) Details
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