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4-哌啶甲酸

4-哌啶甲酸用途

异壬酸是GABAA受体部分激动剂[1]。

4-哌啶甲酸名称

[ CAS 号 ]:
498-94-2

[ 中文名 ]:
4-哌啶甲酸

[ 英文名 ]:
Isonipecotic acid

[中文别名 ]:

[英文别名 ]:

Isonipecotic acid
4-Hexahydroisonicotinic acid
Piperidine-4-carboxylic acid
UNII-M5TZP1RWIE
4-Piperidinecarboxylic acid
Hexahydroisonicotinic acid
EINECS 207-872-3
MFCD00006004
Isonipecoticacid

4-哌啶甲酸生物活性

[ 描述 ]:

异壬酸是GABAA受体部分激动剂[1]。

[ 相关类别 ]:

信号通路 >> 跨膜转运 >> GABA受体

研究领域 >> 神经疾病

信号通路 >> 神经信号通路 >> GABA受体

[ 靶点 ]

GABAA Receptor[1]

[体外研究]

异壬酸抑制[3H]GABA结合(2°C),IC50为0.33μM[2]。

[参考文献]

[1]. Krehan D, et al. Phosphinic, phosphonic and seleninic acid bioisosteres of isonipecotic acid as novel and selective GABA(C) receptor antagonists. Neurochem Int. 2003 Jun;42(7):561-5.

[2]. Falch E, et al. GABA-mimetic activity and effects on diazepam binding of aminosulphonic acids structurally related to piperidine-4-sulphonic acid. J Neurochem. 1985 Jan;44(1):68-75.

4-哌啶甲酸物理化学性质

[ 密度 ]:
1.1±0.1 g/cm3

[ 沸点 ]:
265.8±33.0 °C at 760 mmHg

[ 熔点 ]:
>300 °C(lit.)

[ 分子式 ]:
C₆H₁₁NO₂

[ 分子量 ]:
129.157

[ 闪点 ]:
114.5±25.4 °C

[ 精确质量 ]:
129.078979

[ PSA ]:
49.33000

[ LogP ]:
-0.08

[ 外观性状 ]:
白色至淡的粉红色-米色粉末

[ 蒸汽压 ]:
0.0±1.1 mmHg at 25°C

[ 折射率 ]:
1.479

[ 储存条件 ]:
Store at 0-5°C

[ 水溶解性 ]:
soluble

4-哌啶甲酸MSDS

4-哌啶甲酸毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NS5150000

CHEMICAL NAME :: Isonipecotic acid

CAS REGISTRY NUMBER :: 498-94-2

BEILSTEIN REFERENCE NO. :: 0112553

LAST UPDATED :: 199709

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C6-H11-N-O2

MOLECULAR WEIGHT :: 129.18

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 2100 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: THERAP Therapie. (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris, France) V.1- 1946- Volume(issue)/page/year: 23,1343,1968

4-哌啶甲酸安全信息

[ 符号 ]:

GHS07

[ 信号词 ]:
Warning

[ 危害声明 ]:
H315-H319-H335

[ 警示性声明 ]:
P261-P305 + P351 + P338

[ 个人防护装备 ]:
dust mask type N95 (US);Eyeshields;Gloves

[ 危害码 (欧洲) ]:
Xi:Irritant

[ 风险声明 (欧洲) ]:
R36/37/38

[ 安全声明 (欧洲) ]:
S26-S36-S37/39

[ 危险品运输编码 ]:
NONH for all modes of transport

[ WGK德国 ]:
3

[ RTECS号 ]:
NS5150000

[ 海关编码 ]:
2942000000

4-哌啶甲酸合成路线

4-哌啶甲酸上下游产品

4-哌啶甲酸上游产品

4-哌啶甲酸下游产品

4-哌啶甲酸海关

[ 海关编码 ]: 2933399090

[ 中文概述 ]:
2933399090. 其他结构含非稠合吡啶环的化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

[ 申报要素 ]: 品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期

[ Summary ]:
2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

4-哌啶甲酸文献

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Nat. Chem. Biol. 5 , 765-71, (2009)

Studies of gene function and molecular mechanisms in Plasmodium falciparum are hampered by difficulties in characterizing and measuring phenotypic differences between individual parasites. We screened...

Three-dimensional quantitative structure-activity relationship analyses of substrates of the human proton-coupled amino acid transporter 1 (hPAT1).

Bioorg. Med. Chem. 19 , 6409-18, (2011)

The proton-coupled amino acid transporter hPAT1 has recently gained much interest due to its ability to transport small drugs thereby allowing their oral administration. A three-dimensional quantitati...

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