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苯甲酰新乌头原碱

苯甲酰新乌头原碱用途

Benzoylmesaconine是乌头汤最丰富的组分,乌头汤对类风湿性关节炎的治疗效果在中国广泛使用。

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苯甲酰新乌头原碱名称

[ CAS 号 ]:
63238-67-5

[ 中文名 ]:
苯甲酰新乌头原碱

[ 英文名 ]:
Benzoylmesaconine

[英文别名 ]:

Benzoylmesaconitine
O8-Deacetylmesaconitine
Mesaconine 14-benzoate
8-Deacetylmesaconitine
Benzoylmesaconine

苯甲酰新乌头原碱生物活性

[ 描述 ]:

Benzoylmesaconine是乌头汤最丰富的组分,乌头汤对类风湿性关节炎的治疗效果在中国广泛使用。

[ 相关类别 ]:

信号通路 >> 其他 >> 其他

天然产物 >> 生物碱

研究领域 >> 其他

[参考文献]

[1]. Dai PM, et al. Pharmacokinetic comparisons of benzoylmesaconine in rats using ultra-performance liquid chromatography-tandem mass spectrometry after administration of pure benzoylmesaconine and Wutou decoction. Molecules. 2014 Oct 17;19(10):16757-69.

[2]. Ye L, et al. Monoester-Diterpene Aconitum Alkaloid Metabolism in Human Liver Microsomes: Predominant Role of CYP3A4 and CYP3A5. Evid Based Complement Alternat Med. 2013;2013:941093.

[相关活性小分子]

苯甲酰新乌头原碱物理化学性质

[ 密度 ]:
1.4±0.1 g/cm3

[ 沸点 ]:
703.2±60.0 °C at 760 mmHg

[ 分子式 ]:
C₃₁H₄₃NO₁₀

[ 分子量 ]:
589.674

[ 闪点 ]:
379.1±32.9 °C

[ 精确质量 ]:
589.288696

[ PSA ]:
147.38000

[ LogP ]:
0.37

[ 蒸汽压 ]:
0.0±2.3 mmHg at 25°C

[ 折射率 ]:
1.637

[ 储存条件 ]:
2~8℃

苯甲酰新乌头原碱毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: AR5562770

CHEMICAL NAME :: Aconitane-3,8,13,14,15-pentol, 4-(methoxymethyl)-20-methyl-1,6,16-trimethoxy-, 14-benzoate, (1-alpha,3-alpha,6-alpha,14-alpha,15-alpha,16-beta)-

CAS REGISTRY NUMBER :: 63238-67-5

BEILSTEIN REFERENCE NO. :: 0072534

LAST UPDATED :: 199612

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C31-H43-N-O10

MOLECULAR WEIGHT :: 589.75

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 810 mg/kg

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

REFERENCE :: JOETD7 Journal of Ethnopharmacology. (Elsevier Scientific Pub. Ireland Ltd., POB 85, Limerick, Ireland) V.1- 1979- Volume(issue)/page/year: 4,247,1981

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 240 mg/kg

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

REFERENCE :: JOETD7 Journal of Ethnopharmacology. (Elsevier Scientific Pub. Ireland Ltd., POB 85, Limerick, Ireland) V.1- 1979- Volume(issue)/page/year: 4,247,1981

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

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 230 mg/kg

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

REFERENCE :: JOETD7 Journal of Ethnopharmacology. (Elsevier Scientific Pub. Ireland Ltd., POB 85, Limerick, Ireland) V.1- 1979- Volume(issue)/page/year: 4,247,1981

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 21 mg/kg

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

REFERENCE :: JJTOEX Japanese Journal of Toxicology. (Yakugyo Jihosha, Hokushin Bldg., 2-36 Jinbo-cho, Kanda, Chiyoda-ku, Tokyo, 101, Japan) V.1- 1988- Volume(issue)/page/year: 2,225,1989

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苯甲酰新乌头原碱安全信息

[ 危害码 (欧洲) ]:
Xi