16298-90-1

• 常用中文名：jesaconitine
• 常用英文名：jesaconitine
• CAS号：16298-90-1
• 分子式：C₃₅H₄₉NO₁₂
• 分子量：675.76
• 相关类别： 研究领域 心血管疾病
• 发布时间：2016-09-10 02:22:51
• 更新时间：2024-01-18 11:25:55
• 副乌头碱是一种有毒生物碱。乌头碱可以从乌头中提取。乌头碱是乌头中毒后右心房血液中可检测到的主要代谢产物之一。乌头碱中毒具有多种类型的心律失常特征[1]。

名称

• 英文名: (1α,3α,6α,14α,15α,16β)-8-Acetoxy-20-ethyl-3,13,15-trihydroxy-1,6, 16-trimethoxy-4-(methoxymethyl)aconitan-14-yl 4-methoxybenzoate
• 英文别名: N-Desethyl-N-Methylaconitine; Mesaaconitine; Japaconitine A; Japaconitine B; Jesaconitine

物化性质

• 密度: 1.37g/cm3
• 沸点: 748.1ºC at 760 mmHg
• 分子式: C₃₅H₄₉NO₁₂
• 分子量: 675.76
• 闪点: 406.2ºC
• 精确质量: 675.32500
• PSA: 162.68000
• LogP: 0.59460
• 蒸汽压: 1.66E-23mmHg at 25°C
• 折射率: 1.608

生物活性

• 描述: 副乌头碱是一种有毒生物碱。乌头碱可以从乌头中提取。乌头碱是乌头中毒后右心房血液中可检测到的主要代谢产物之一。乌头碱中毒具有多种类型的心律失常特征[1]。
• 相关类别:
  研究领域 >> 心血管疾病
  信号通路 >> 其他 >> 其他
• 参考文献:

  [1]. Natori Y, et al. A simple and rapid method for quantifying aconitines and their metabolites in whole blood by modified QuEChERS and liquid chromatography/tandem mass spectrometry (LC/MS/MS). Forensic Sci Int. 2022 Dec;341:111475.

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : AR5562540 CHEMICAL NAME : Aconitane-3,8,13,14,15-pentol, 20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)-, 8-acetate 14-(4-methoxybenzoate), (1-alpha,3-alpha,6-alpha,14-alpha,15-alpha,16-beta)- CAS REGISTRY NUMBER : 16298-90-1 BEILSTEIN REFERENCE NO. : 0075405 LAST UPDATED : 199612 DATA ITEMS CITED : 5 MOLECULAR FORMULA : C35-H49-N-O12 MOLECULAR WEIGHT : 675.85 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 350 ug/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : CTYAD8 Zhongcaoyao. Chinese Traditional and Herbal Medicine. (China International Book Trading Corp., POB 2820, Beijing, Peop. Rep. China) V.11- 1980- Volume(issue)/page/year: 15,180,1984 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 230 ug/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : CPBTAL Chemical and Pharmaceutical Bulletin. (Japan Pub. Trading Co., USA, 1255 Howard St., San Francisco, CA 94103) V.6- 1958- Volume(issue)/page/year: 39,379,1991 TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Mammal - cat DOSE/DURATION : 80 ug/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : YAKUD5 Gekkan Yakuji. Pharmaceuticals Monthly. (Yakugyo Jihosha, Inaoka Bldg., 2-36 Jinbo-cho, Kanda, Chiyoda-ku, Tokyo 101, Japan) V.1- 1959- Volume(issue)/page/year: 23,873,1981 TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - rabbit DOSE/DURATION : 50 ug/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : YAKUD5 Gekkan Yakuji. Pharmaceuticals Monthly. (Yakugyo Jihosha, Inaoka Bldg., 2-36 Jinbo-cho, Kanda, Chiyoda-ku, Tokyo 101, Japan) V.1- 1959- Volume(issue)/page/year: 23,873,1981 TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - guinea pig DOSE/DURATION : 30 ug/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : YAKUD5 Gekkan Yakuji. Pharmaceuticals Monthly. (Yakugyo Jihosha, Inaoka Bldg., 2-36 Jinbo-cho, Kanda, Chiyoda-ku, Tokyo 101, Japan) V.1- 1959- Volume(issue)/page/year: 23,873,1981

合成路线

64-19-7 119212-27-0 ~% 16298-90-1

文献：Chemical and Pharmaceutical Bulletin, , vol. 36, # 4 p. 1604 - 1606

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