Dimethylarsinate
SmallMolecule
T3DB_ID
T3D0075
描述
Cacodylic acid is the chemical compound with the formula (CH3)2AsO2H. Derivatives of cacodylic acid, cacodylates, were frequently used as herbicides. For example, Agent Blue, one of the chemicals used during the Vietnam War, is a mixture of cacodylic acid and sodium cacodylate. Sodium cacodylate is frequently used as a buffering agent in the preparation and fixation of biological samples for transmission electron microscopy. Cacodylic acid is highly toxic by ingestion, inhalation, or skin contact. Once thought to be a byproduct of inorganic arsenic detoxification, it is now believed to have serious health consequences of its own. It has been shown to be teratogenic in rodents, most often causing cleft palate but also fetal fatality at high doses. It has been shown to be genotoxic in human cells, causing apoptosis and also decreased DNA production and shorter DNA strands. While not itself a strong carcinogen, cacodylic acid does promote tumors in the presence of carcinogens in organs such as the kidneys and liver. (Wikipedia).
类别
"Pesticide", "Household Toxin", "Industrial/Workplace Toxin", "Food Toxin", "Synthetic Toxin"
同义词
"Ansar", "Arsan", "Bolate", "Bolls", "Cacodylate", "Cacodylic acid", "Chexmate", "Dimethylarsinic acid", "DMAA", "Erase", "Hydroxydimethylarsine oxide", "Moncide", "Phytar", "Phytar 560", "Silvisar"
CAS登记号
15132-04-4
化学式
C2H7AsO2
平均分子量
137.9974
单同位素质量
137.966200885
IUPAC 名称
dimethylarsinic acid
传统名称
ansar
简化分子线性输入规范
C[As](C)(O)=O
InChI 标识符
InChI=1S/C2H7AsO2/c1-3(2,4)5/h1-2H3,(H,4,5)
InChIKey=OGGXGZAMXPVRFZ-UHFFFAOYSA-N
化合物类型
Organic compounds
大分类
Organometallic compounds
类型
Organometalloid compounds
子类
Organoarsenic compounds
直接大类
Pentaorganoarsanes
另外分类
"Alkylarsine oxides", "Hydrocarbon derivatives", "Organic metalloid salts", "Organic oxides", "Organopnictogen compounds"
取代基
"Aliphatic acyclic compound", "Alkylarsine oxide", "Hydrocarbon derivative", "Organic metalloid salt", "Organic oxide", "Organic oxygen compound", "Organic salt", "Organopnictogen compound", "Oxygen-containing organoarsenic compound", "Pentaorganoarsane"
分子框架
Aliphatic acyclic compounds
外部描述符
"Arsenical herbicides", "organoarsenic compound"
地位
Detected and Not Quantified
起源
Exogenous
蜂窝位置
"Cytoplasm", "Extracellular"
生物流体位置
组织位置
途径
状态
Solid
外貌
Colorless solid.
熔点/沸点/溶解度
195°C/>200°C/2000 mg/mL at 25 °C [YALKOWSKY,SH & DANNENFELSER,RM (1992)]
日志P
暴露途径
Oral (L2) ; inhalation (L2); dermal (L2)
毒性机制
Arsenic and its metabolites disrupt ATP production through different mechanisms. At the level of the citric acid cycle, arsenic inhibits the pyruvate dehydrogenase and uncouples the oxidative phosphorylation by competing with phosphate. This leads to inhibition of energy-linked reduction of NAD+, mitochondrial respiration, and ATP synthesis. Hydrogen peroxide production is increased, leading to oxidative stress due to the formation of reactive oxygen species. Arsenic's carginogenicity is influenced by the arsenical binding of tubulin, which results in aneuploidy, polyploidy and mitotic arrests. The binding of other arsenic protein targets may also cause altered DNA repair enzyme activity, altered DNA methylation patterns and cell proliferation. (T1, A17)
代谢
Arsenic and its metabolites are primarily excreted in the urine. (L2)
毒性值
LD50: 644 mg/kg (Oral, Rat) (T14) LD50: 720 mg/kg (Intraperitoneal, Rat) (T32)
致死剂量
致癌性
2B, possibly carcinogenic to humans. (L135)
用途/来源
Dimethylarsinic acid is used as an herbicide and pesticide. (L180)
最低风险等级
健康影响
Arsenic poisoning can lead to death from multi-system organ failure, probably from necrotic cell death, not apoptosis. Arsenic is also a known carcinogen, especially in skin, liver, bladder and lung cancers. (T1, L20)
症状
Exposure to lower levels of arsenic can cause nausea and vomiting, decreased production of red and white blood cells, abnormal heart rhythm, damage to blood vessels, and a sensation of “pins and needles” in hands and feet. Breathing high levels of inorganic arsenic can provoque sore throat or irritated lungs. Arsenic also affects the brain, causing neurological disturbances such as headaches, confusion, and drowsiness. (A1)
治疗
Arsenic poisoning can be treated by chelation therapy, using chelating agents such as dimercaprol, EDTA or DMSA. Charcoal tablets may also be used for less severe cases. In addition, maintaining a diet high in sulfur helps eliminate arsenic from the body. (L20)
药库 ID
DB02994
HMDB_ID
HMDB11625
PubChem 化合物 ID
167250
维基百科链接
http://en.wikipedia.org/wiki/Cacodylic acid
创建于
2009-03-06 18:58:02 UTC
更新于
2014-12-24 20:21:03 UTC
目标
毒素T3DB ID毒素名称目标名称
T3D0075 Dimethylarsinate Guanine nucleotide-binding protein G(t) subunit alpha-1
T3D0075 Dimethylarsinate Aldose reductase
T3D0075 Dimethylarsinate Nitric oxide synthase, endothelial
T3D0075 Dimethylarsinate Tubulin gamma-2 chain
T3D0075 Dimethylarsinate Tubulin gamma-1 chain
T3D0075 Dimethylarsinate Tubulin epsilon chain
T3D0075 Dimethylarsinate Tubulin delta chain
T3D0075 Dimethylarsinate Tubulin beta-8 chain-like protein LOC260334
T3D0075 Dimethylarsinate Tubulin beta-8 chain
T3D0075 Dimethylarsinate Tubulin beta-6 chain
T3D0075 Dimethylarsinate Tubulin beta-4A chain
T3D0075 Dimethylarsinate Tubulin beta-3 chain
T3D0075 Dimethylarsinate Tubulin beta-4B chain
T3D0075 Dimethylarsinate Tubulin beta-2B chain
T3D0075 Dimethylarsinate Tubulin beta-2A chain
T3D0075 Dimethylarsinate Tubulin beta-1 chain
T3D0075 Dimethylarsinate Tubulin beta chain
T3D0075 Dimethylarsinate Tubulin alpha-8 chain
T3D0075 Dimethylarsinate Tubulin alpha-4A chain
T3D0075 Dimethylarsinate Tubulin alpha-3E chain
T3D0075 Dimethylarsinate Tubulin alpha-3C/D chain
T3D0075 Dimethylarsinate Tubulin alpha-1C chain
T3D0075 Dimethylarsinate Tubulin alpha-1B chain
T3D0075 Dimethylarsinate Tubulin alpha-1A chain
T3D0075 Dimethylarsinate Tubulin alpha chain-like 3
T3D0075 Dimethylarsinate Thioredoxin reductase 3
T3D0075 Dimethylarsinate Thioredoxin reductase 2, mitochondrial
T3D0075 Dimethylarsinate Thioredoxin reductase 1, cytoplasmic
T3D0075 Dimethylarsinate Pyruvate dehydrogenase protein X component, mitochondrial
T3D0075 Dimethylarsinate Pyruvate dehydrogenase E1 component subunit beta, mitochondrial
T3D0075 Dimethylarsinate Pyruvate dehydrogenase E1 component subunit alpha, testis-specific form, mitochondrial
T3D0075 Dimethylarsinate Pyruvate dehydrogenase E1 component subunit alpha, somatic form, mitochondrial
T3D0075 Dimethylarsinate Putative tubulin-like protein alpha-4B
T3D0075 Dimethylarsinate Putative tubulin beta-4q chain
T3D0075 Dimethylarsinate Putative tubulin beta chain-like protein ENSP00000290377
T3D0075 Dimethylarsinate Poly [ADP-ribose] polymerase 1
T3D0075 Dimethylarsinate Kelch-like ECH-associated protein 1
T3D0075 Dimethylarsinate Haptoglobin
T3D0075 Dimethylarsinate Glutathione reductase, mitochondrial
T3D0075 Dimethylarsinate Glucocorticoid receptor
T3D0075 Dimethylarsinate Estrogen receptor alpha
T3D0075 Dimethylarsinate DNA repair protein complementing XP-A cells
T3D0075 Dimethylarsinate Dihydrolipoyllysine-residue acetyltransferase component of pyruvate dehydrogenase complex, mitochondrial
T3D0075 Dimethylarsinate Actin, gamma-enteric smooth muscle
T3D0075 Dimethylarsinate Actin, cytoplasmic 2
T3D0075 Dimethylarsinate Actin, cytoplasmic 1
T3D0075 Dimethylarsinate Actin, aortic smooth muscle
T3D0075 Dimethylarsinate Actin, alpha skeletal muscle
T3D0075 Dimethylarsinate Actin, alpha cardiac muscle 1
T3D0075 Dimethylarsinate Hemoglobin subunit beta
T3D0075 Dimethylarsinate Hemoglobin subunit alpha
T3D0075 Dimethylarsinate Interleukin-8
T3D0075 Dimethylarsinate Cytochrome P450 2B6
T3D0075 Dimethylarsinate Macrophage colony-stimulating factor 1
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