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methoxychlor

Identification (Source:EPA,EU)

ID	1470
Name	methoxychlor
CAS	72-43-5
IUPAC	1,1,1-trichloro-2,2-bis(4-methoxyphenyl)ethane
Inchi	InChI=1S/C16H15Cl3O2/c1-20-13-7-3-11(4-8-13)15(16(17,18)19)12-5-9-14(21-2)10-6-12/h3-10,15H,1-2H3
CIPAC	14
EPA Code	034001
Formula	C16H15Cl3O2
SMILES	ClC(Cl)(Cl)C(c1ccc(OC)cc1)c2ccc(OC)cc2
Status	Not Approved

Classification

Mode of Action	Contact and stomach action. Central nervous stimulant, producing hyperactivity, convulsions and death.
Pesticide Type	Insecticide
Chemical Group	Organochlorine
Classification	organochlorine insecticides

Properties (Source:PubChem)

Molecular Weight	345.65
Physical State	Colourless crystalline solid
AlogP	4.969
H-Bond Donor	0
H-Bond Acceptor	2
Surface Area	319.24
Polar Surface Area	18.46

Structure

Ecotoxicology (Source:PPDB,IPM)

Species	Method	Study Time	Dose Type	Value
Algae	Acute	72 hour	EC50, growth	0.6 mg l-1
Aquatic invertebrates	Acute	48 hour	EC50	0.00078 mg l-1
Birds	Acute		LD50	2000 mg kg-1
Fish	Acute	96 hour	LC50	0.052 mg l-1
Honeybees	Acute	48 hour	LD50	23.6 μg bee-1
Mammals	Acute oral		LD50	> 6000 mg kg-1
Mammals	Short term dietary		NOEL	200 ppm diet
	Bio-concentration factor		CT50	Not available days
	Bio-concentration factor		BCF	1622

Related targets

Target Name	RScore (About this table)
estrogen receptor alpha	1957(17,30,35,182)	Details
cytochrome P450 (protein family or complex)	964(10,13,18,49)	Details
CYP2C19	751(7,12,14,31)	Details
CYP2C9	454(4,8,8,14)	Details
CYP3A	392(4,5,7,32)	Details
androgen receptor	359(3,6,6,29)	Details
P450scc	258(3,3,4,13)	Details
ERbeta	331(2,6,7,46)	Details
CYP2B	312(2,6,8,22)	Details
ID1	200(2,3,4,5)	Details
CYP2B6	179(2,2,2,19)	Details
constitutive androstane receptor	168(2,2,2,8)	Details
microsomal monooxygenases	163(2,2,2,3)	Details
CYP1	143(1,3,3,3)	Details
Lactoferrin	136(1,2,5,11)	Details
CYP1A2	128(1,2,3,13)	Details
multidrug resistance associated protein 1	119(1,2,3,4)	Details
CREB	114(1,2,2,4)	Details
CYP1A1	87(1,1,1,7)	Details
anti Mullerian hormone	83(1,1,1,3)	Details
cytochrome P450 monooxygenase	82(1,1,1,2)	Details
NADPH cytochrome P450 reductase	81(1,1,1,1)	Details
GT1	44(0,1,2,9)	Details
bcl 2	42(0,1,1,12)	Details
CYP2C18	38(0,1,2,3)	Details
chitinase	38(0,1,1,8)	Details
Microsomal monooxygenase	38(0,1,2,3)	Details
HSP72	37(0,1,2,2)	Details
NF kappa B	35(0,1,1,5)	Details
demethylase	34(0,1,1,4)	Details
CYP2A6	33(0,1,1,3)	Details
androgen binding protein	33(0,1,1,3)	Details
cytochrome b 5	33(0,1,1,3)	Details
AP1	32(0,1,1,2)	Details
UGT1A	32(0,1,1,2)	Details
protein kinase A (protein family or complex)	31(0,1,1,1)	Details
glutathione S transferase	24(0,0,3,9)	Details

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