1111-39-3

• 常用中文名：乙酰洋地黄毒甙
• 常用英文名：acetyldigitoxin
• CAS号：1111-39-3
• 分子式：C₄₃H₆₆O₁₄
• 分子量：806.97600
• 相关类别： 原料药 循环系统用药 抗充血性心力衰竭药
• 发布时间：2018-09-18 10:29:46
• 更新时间：2024-01-03 00:33:37
• 乙酰洋地黄毒素(洋地黄素3'''-乙酸酯)是一种强心苷。乙酰洋地黄毒素可以来自洋地黄属植物的叶子。乙酰洋地黄毒素降低心率,可用于心力衰竭研究[1][2]。

名称

• 中文名: 乙酰洋地黄毒甙
• 英文名: 3'''-O-acetyldigitoxin
• 中文别名: 黄黄甙
• 英文别名: Acetildigitoxina; 3'''-Acetyldigitoxin; Digitoxigenin 3-O-bisdigitoxosidoacetodigitoxoside; Acetyldigitoxinum; 3'"-O-acetyl digitoxin; digitoxin 3"'-acetate; EINECS 214-178-4; ACETYLDIGITOXIN; acylanid; adicin; Acedigal; Acetyl-digitoxine

物化性质

• 密度: 1.31g/cm3
• 沸点: 902.2ºC at 760 mmHg
• 熔点: 217-221°
• 分子式: C₄₃H₆₆O₁₄
• 分子量: 806.97600
• 闪点: 265ºC
• 精确质量: 806.44500
• PSA: 188.90000
• LogP: 3.81810
• 蒸汽压: 0mmHg at 25°C
• 折射率: 1.582
• 储存条件:

  库房通风低温干燥

• 稳定性:

  1.可燃; 加热分解释放刺激烟雾

• 分子结构:

  1、 摩尔折射率：204.66

  2、 摩尔体积（cm³/mol）：612.7

  3、 等张比容（90.2K）：1697.8

  4、 表面张力（dyne/cm）：58.9

  5、 极化率（10-24cm3）：81.13

生物活性

• 描述: 乙酰洋地黄毒素(洋地黄素3'''-乙酸酯)是一种强心苷。乙酰洋地黄毒素可以来自洋地黄属植物的叶子。乙酰洋地黄毒素降低心率,可用于心力衰竭研究[1][2]。
• 相关类别:
  研究领域 >> 其他
  信号通路 >> 其他 >> 其他
• 参考文献:

  [1]. LU FC, et, al. A comparative study on some pharmacological effects of digitoxin, acetyldigitoxin and gitalin (amorphous) in cats. J Pharm Pharmacol. 1958 Jun;10(6):375-9.

  [2]. APPEL RM, et, al. A preliminary phytochemical investigation of Digitalis ferruginea. J Am Pharm Assoc Am Pharm Assoc. 1954 Apr;43(4):215-9.

毒性和生态

毒理学数据: 口服-猫 LD50: 0.250 毫克/公斤； 静脉-猫 LDL0：0.514 毫克/公斤 CHEMICAL IDENTIFICATION RTECS NUMBER : IH2450000 CHEMICAL NAME : Digitoxin, acetate, alpha- CAS REGISTRY NUMBER : 1111-39-3 BEILSTEIN REFERENCE NO. : 0077291 LAST UPDATED : 199612 DATA ITEMS CITED : 8 MOLECULAR FORMULA : C43-H66-O14 MOLECULAR WEIGHT : 807.09 WISWESSER LINE NOTATION : L E5 B666TJ A1 E1 IOV1 F- DT5OV EHJ& OO- FT6OTJ B1 DQ CO- FT6OTJ B1 DQ CO- FT6OTJ B1 CQ DQ 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 : 7300 ug/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : NYKZAU Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. (Nippon Yakuri Gakkai, c/o Kyoto Daigaku Igakubu Yakurigaku Kyoshitsu, Konoe-cho, Yoshida, Sakyo-ku, Kyoto 606, Japan) V.40- 1944- Volume(issue)/page/year: 54,58,1958 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 2780 ug/kg TOXIC EFFECTS : Behavioral - convulsions or effect on seizure threshold Behavioral - food intake (animal) Lungs, Thorax, or Respiration - dyspnea REFERENCE : FATOAO Farmakologiya i Toksikologiya (Moscow). For English translation, see PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2- 1939- Volume(issue)/page/year: 43,170,1980 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Mammal - cat DOSE/DURATION : 250 ug/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 159,1,1966 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Mammal - cat DOSE/DURATION : 514 ug/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 111,365,1954 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - guinea pig DOSE/DURATION : >30 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 159,1,1966 TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - guinea pig DOSE/DURATION : 1700 ug/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 15,481,1965 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Amphibian - frog DOSE/DURATION : 2800 ug/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : FATOAO Farmakologiya i Toksikologiya (Moscow). For English translation, see PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2- 1939- Volume(issue)/page/year: 43,170,1980 *** REVIEWS *** TOXICOLOGY REVIEW 85ELDJ "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963 Volume(issue)/page/year: -,187,1963

安全

• 危险品运输编码: UN 3249
• 包装等级: II
• 危险类别: 6.1(a)

合成路线

25876-27-1 ~% 1111-39-3

文献：Yoshida, Keisuke; Furuta, Takumi; Kawabata, Takeo Tetrahedron Letters, 2010 , vol. 51, # 37 p. 4830 - 4832

110-86-1 71-63-6 ~% 1111-39-3

文献：Satoh et al. Pharmaceutical Bulletin, 1957 , vol. 5, p. 627