Aldrin
SmallMolecule
T3DB_ID
T3D0024
描述
Aldrin is a chlorinated hydrocarbon used as an insecticide. Once in the insect, aldrin is oxidized into dieldrin, a neurotoxin. Due to the toxicity and ability of bioaccumulate of dieldrin, the use of aldrin is now banned in most parts of the world. (L144)
类别
"Pesticide", "Pollutant", "Synthetic Toxin"
同义词
"Aldocit", "Aldrex", "Aldrex 30", "Aldrex 40", "Aldrin dust", "Aldrin-r", "Aldrite", "Aldron", "Aldrosol", "Algran", "Altox", "Drinox", "Hexachlorohexahydro-endo, exo-dimethanonaphthalene", "Hexachlorohexahydro-endo,exo-dimethanonaphthalene", "Hexachlorohexahydro-endo-exo-dimethanonaphthalene", "HHDN", "HHPN", "Kortofin", "Murald", "Octalene", "Seedrin", "Soilgrin", "Tatuzinho", "Tipula"
CAS登记号
309-00-2
化学式
C12H8Cl6
平均分子量
364.91
单同位素质量
361.875716498
IUPAC 名称
(1R,8S)-1,8,9,10,11,11-hexachlorotetracyclo[6.2.1.1³,⁶.0²,⁷]dodeca-4,9-diene
传统名称
(1R,8S)-1,8,9,10,11,11-hexachlorotetracyclo[6.2.1.1³,⁶.0²,⁷]dodeca-4,9-diene
简化分子线性输入规范
ClC1=C(Cl)[C@]2(Cl)C3C4CC(C=C4)C3[C@@]1(Cl)C2(Cl)Cl
InChI 标识符
InChI=1/C12H8Cl6/c13-8-9(14)11(16)7-5-2-1-4(3-5)6(7)10(8,15)12(11,17)18/h1-2,4-7H,3H2/t4?,5?,6?,7?,10-,11+
InChIKey=QBYJBZPUGVGKQQ-LYSYVJQENA-N
化合物类型
Organic compounds
大分类
Organohalogen compounds
类型
Vinyl halides
子类
Vinyl chlorides
直接大类
Vinyl chlorides
另外分类
"Alkyl chlorides", "Chloroalkenes", "Hydrocarbon derivatives", "Organochlorides"
取代基
"Aliphatic homopolycyclic compound", "Alkyl chloride", "Alkyl halide", "Chloroalkene", "Haloalkene", "Hydrocarbon derivative", "Organochloride", "Vinyl chloride"
分子框架
Aliphatic homopolycyclic compounds
外部描述符
""
地位
Detected and Not Quantified
起源
Exogenous
蜂窝位置
"Membrane"
生物流体位置
组织位置
途径
状态
Solid
外貌
White powder.
熔点/沸点/溶解度
104°C//1.7e-05 mg/mL at 25 °C [YALKOWSKY,SH & DANNENFELSER,RM (1992)]
日志P
暴露途径
Oral (L87) ; inhalation (L87) ; dermal (L87)
毒性机制
Aldrin antagonizes the action of the neurotransmitter gamma-aminobutyric acid (GABA) acting at the GABA-A receptors, effectively blocking the GABA-induced uptake of chloride ions. Aldrin also inhibits Na+ K+ ATPase and Ca2+ and Mg2+ ATPase which are essential for the transport of calcium across membranes. This results in the accumulation of intracellular free calcium ions, which promotes release of neurotransmitters from storage vesicles, the subsequent depolarization of adjacent neurons, and the propagation of stimuli throughout the CNS. This results in hyperexcitation and generalized seizures. (T10, L87)
代谢
Aldrin is absorbed throught the gastrointestinal tract, lungs and skin. Following absorption, aldrin is redistributed primarily to fat via the lymphatic system. Once in the body, aldrin is readily converted to dieldrin, primarily in the liver by mixed-function oxidases of the cytochrome P-450 system, and to a lesser extent in the lung and skin. Aldrin may also be epoxidized to dieldrin by a prostaglandin synthetase-mediated pathway inextrahepatic tissues. Dieldrin is metabolized by liver microsomal monooxygenases and epoxide hydratases. Its metabolites, of which the primary one is 9-hydroxydieldrin, are excreted in the faeces. (L87)
毒性值
LD50: 39 mg/kg (Oral, Rat) (T18) LD50: 98 mg/kg (Dermal, Rat) (T18) LD50: 150 mg/kg (Intraperitoneal, Rat) (T17) LD50: 21 mg/kg (Intravenous, Mouse) (T17)
致死剂量
5 to 7 grams for an adult human. (T19)
致癌性
3, not classifiable as to its carcinogenicity to humans. (L135)
用途/来源
Aldrin is used as an insecticide. (L144)
最低风险等级
Acute Oral: 0.002 mg/kg/day (L134) Chronic Oral: 0.00003 mg/kg/day (L134)
健康影响
Aldrin is a neurotoxin and works by overstimulating the central nervous system. Ingestion of large amounts of aldrin causes convulsions and death. However, chronic exposure to lower amounts of aldrin also has adverse affects because it is oxidized to dieldrin, which accumulates in the body. Dieldrin is known to damage the nervous system, liver, and immune system. (L87)
症状
Exposure to aldrin results in headaches, dizziness, irritability, nausea and vomiting, cardiac arrhythmias, muscular weakness, uncontrolled muscle movements, hyperexcitability, seizures and coma. (L87)
治疗
Treatment is symptomatic, aimed at controlling convulsions, coma, and respiratory depression. If ingested, gastric lavage may be performed, followed by administering activated charcoal powder. (L145)
药库 ID
HMDB_ID
PubChem 化合物 ID
61103
维基百科链接
http://en.wikipedia.org/wiki/Aldrin
创建于
2009-03-06 18:57:56 UTC
更新于
2014-12-24 20:20:54 UTC
目标
毒素T3DB ID毒素名称目标名称
T3D0024 Aldrin Estrogen receptor beta
T3D0024 Aldrin Estrogen receptor alpha
T3D0024 Aldrin Progesterone receptor
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit theta
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit rho-3
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit gamma-1
T3D0024 Aldrin Retinoic acid receptor gamma-2
T3D0024 Aldrin Nuclear receptor subfamily 1 group I member 2
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit epsilon
T3D0024 Aldrin Sarcoplasmic/endoplasmic reticulum calcium ATPase 3
T3D0024 Aldrin Sarcoplasmic/endoplasmic reticulum calcium ATPase 2
T3D0024 Aldrin Sarcoplasmic/endoplasmic reticulum calcium ATPase 1
T3D0024 Aldrin Plasma membrane calcium-transporting ATPase 4
T3D0024 Aldrin Plasma membrane calcium-transporting ATPase 3
T3D0024 Aldrin Plasma membrane calcium-transporting ATPase 2
T3D0024 Aldrin Plasma membrane calcium-transporting ATPase 1
T3D0024 Aldrin Calcium-transporting ATPase type 2C member 2
T3D0024 Aldrin Calcium-transporting ATPase type 2C member 1
T3D0024 Aldrin Sodium/potassium-transporting ATPase subunit gamma
T3D0024 Aldrin Sodium/potassium-transporting ATPase subunit beta-3
T3D0024 Aldrin Sodium/potassium-transporting ATPase subunit beta-2
T3D0024 Aldrin Sodium/potassium-transporting ATPase subunit beta-1
T3D0024 Aldrin Sodium/potassium-transporting ATPase subunit alpha-4
T3D0024 Aldrin Sodium/potassium-transporting ATPase subunit alpha-3
T3D0024 Aldrin Sodium/potassium-transporting ATPase subunit alpha-2
T3D0024 Aldrin Sodium/potassium-transporting ATPase subunit alpha-1
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit rho-2
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit rho-1
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit pi
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit gamma-3
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit gamma-2
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit delta
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit beta-3
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit beta-2
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit beta-1
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit alpha-6
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit alpha-5
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit alpha-4
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit alpha-3
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit alpha-2
T3D0024 Aldrin Gamma-aminobutyric acid receptor subunit alpha-1
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