monocrotophos

Identification (Source:EPA,EU)

ID 189
Name monocrotophos
CAS 6923-22-4
IUPAC
Inchi InChI=1S/C7H14NO5P/c1-6(5-7(9)8-2)13-14(10,11-3)12-4/h5H,1-4H3,(H,8,9)/b6-5+
CIPAC 287
EPA Code 058903
Formula C7H14NO5P
SMILES O=P(O/C(=C/C(=O)NC)C)(OC)OC
Status Not Approved

Classification

Mode of Action Broad spectrum, systemic with stomach and contact action. Acetylcholinesterase (AChE) inhibitor.
Pesticide Type Insecticide, Acaricide
Chemical Group Organophosphate
Classification organophosphate acaricides
organophosphate insecticides

Properties (Source:PubChem)

Molecular Weight 223.16
Physical State Colourless crystals when pure reddish-brown as technical substance
AlogP -0.63
H-Bond Donor 1
H-Bond Acceptor 5
Surface Area 229.49
Polar Surface Area 83.67

Structure



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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
Aquatic invertebrates Acute 48 hour EC50 0.023 mg l-1
Birds Acute LD50 0.94 mg kg-1
Earthworms Acute 14 day LD50 35 mg kg-1
Fish Acute 96 hour LC50 7.0 mg l-1
Honeybees Acute 48 hour LD50 0.02 μg bee-1
Mammals Acute oral LD50 14 mg kg-1

Related targets

Target Name RScore (About this table)
Acetylcholinesterase 1618(15,22,36,138) Details
anticholinesterase 374(4,4,9,29) Details
MAO B 164(2,2,2,4) Details
glutathione S transferases 118(1,2,2,8) Details
cytochrome c 93(1,1,3,3) Details
alanine aminotransferase 84(1,1,1,4) Details
MAO A 82(1,1,1,2) Details
cis 3 81(1,1,1,1) Details
MCP 135(0,3,8,20) Details
cytochrome P450 (protein family or complex) 67(0,2,2,7) Details
ha 1 40(0,1,2,5) Details
estrogen receptor 31(0,1,1,1) Details
ATPase 30(0,0,4,10) Details
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