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乙酰缬草三酯

乙酰缬草三酯用途

Acevaltrate 从 Valeriana glechomifolia 中分离,抑制大鼠肾和脑半球中 Na+/K+-ATP 酶活性,IC50 分别为 22.8±1.1 μM 和 42.3±1.0 μM[1]。

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乙酰缬草三酯名称

[ CAS 号 ]:
25161-41-5

[ 中文名 ]:
醋戊曲酯

[ 英文名 ]:
Acevaltrate

[中文别名 ]:

[英文别名 ]:

Acevaltrate
Acetoxyvaltrate
EINECS 246-685-1
Acevaltratum
Acetovaltrate

乙酰缬草三酯生物活性

[ 描述 ]:

Acevaltrate 从 Valeriana glechomifolia 中分离,抑制大鼠肾和脑半球中 Na+/K+-ATP 酶活性,IC50 分别为 22.8±1.1 μM 和 42.3±1.0 μM[1]。

[ 相关类别 ]:

信号通路 >> 跨膜转运 >> Na+/K+ATP酶

天然产物 >> 萜类化合物和糖苷

研究领域 >> 神经疾病

[ 靶点 ]

IC50: 22.8±1.1 μM (Na+/K+-ATPase, in rat kidney), 42.3±1.0 μM (Na+/K+-ATPase, in rat brain hemispheres)[1]

[体外研究]

乙酰甲酸酯在体外差异抑制大鼠P型ATP酶的活性。在100μM时实现大鼠H +/K + -ATPase的60.7±7.3％抑制[1]。

[参考文献]

[1]. Bettero GM, et al. In vitro effect of valepotriates isolated from Valeriana glechomifolia on rat P-type ATPases. Planta Med. 2011 Oct;77(15):1702-6.

[相关活性小分子]

乙酰缬草三酯物理化学性质

[ 密度 ]:
1.3±0.1 g/cm3

[ 沸点 ]:
538.7±50.0 °C at 760 mmHg

[ 分子式 ]:
C₂₄H₃₂O₁₀

[ 分子量 ]:
480.505

[ 闪点 ]:
229.0±30.2 °C

[ 精确质量 ]:
480.199554

[ PSA ]:
126.96000

[ LogP ]:
1.91

[ 蒸汽压 ]:
0.0±1.4 mmHg at 25°C

[ 折射率 ]:
1.531

[ 储存条件 ]:
2-8C

乙酰缬草三酯毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: EK7713300

CHEMICAL NAME :: Butanoic acid, 3-(acetyloxy)-3-methyl-, 4-((acetyloxy)methyl)-6,7a-dihydro-1-(3-methyl-1- oxobutoxy)spiro(cyclopenta(c)pyran-7(1H),2'-oxiran)-6 -yl ester, (1S-(1-alpha,6-alpha,7-beta, 7a-alpha))-

CAS REGISTRY NUMBER :: 25161-41-5

LAST UPDATED :: 199703

DATA ITEMS CITED :: 3

MOLECULAR FORMULA :: C24-H32-O10

MOLECULAR WEIGHT :: 480.56

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 65 mg/kg

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

REFERENCE :: USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #3869476

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 7500 mg/kg

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

REFERENCE :: USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #3869476

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 70 mg/kg

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

REFERENCE :: USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #3869476