Endo-3-((3-Hydroxy-2-Phenylpropanoyl)Oxy)-8,8-Dimethyl-8-Azabicyclo[3.2.1]Octan-8-Ium Bromide endo-3-((3-羟基-2-苯基丙酰基)氧基)-8,8-二甲基-8-氮杂双环[3.2.1]辛烷-8-鎓溴化物

CAS 2870-71-5 MFCD00050293

化学结构图

2870-71-5
SMILES: C[N+]1(C)C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2.[Br-]

化学属性

Mol. FormulaC₁₈H₂₆BrNO₃
Mol. Weight384.31
Melting Point215-217°C
Boiling Point

别名和识别编码

Chemical NameEndo-3-((3-Hydroxy-2-Phenylpropanoyl)Oxy)-8,8-Dimethyl-8-Azabicyclo[3.2.1]Octan-8-Ium Bromide
MDL NumberMFCD00050293
EC Number220-700-1
Chemical Name Translationendo-3-((3-羟基-2-苯基丙酰基)氧基)-8,8-二甲基-8-氮杂双环[3.2.1]辛烷-8-鎓溴化物
Synonym ,bromide,endo-(+/-)- 1-alpha-h,5-alpha-h-tropanium,3-alpha-hydroxy-8-methyl-,bromide,(+-)-tropate 3-(3-hydroxy-1-oxo-2-phenylpropoxy)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan 3-alpha-Hydroxy-8-methyl-1-alpha,5-alpha-H-tropanium bromide (+-)tropate 3-alpha-hydroxy-8-methyl-1-alpha,5-alpha-h-tropaniumbromide(+-)tropate 8-Methylatropinium bromide 8-methylatropiniumbromide ATROPINE METHYL BROMIDE ATROPINEMETHYLBROMIDE=N-METHYLATROPINIUMBROMIDE ATROSCINE Atropine Methylbromide EP/JP Atropine methobromide Atropine methylbromide DL-(SCOPOLAMINE HYDROBROMIDE) Hyoscyamine methylbromide Methylatropine Methylatropine bromide Methylatropinium bromide Mintussin Mydriasin N-METHYLATROPINIUM
CAS Number2870-71-5
PubChem Substance ID656597
InChIInChI=1S/C18H26NO3.BrH/c1-19(2)14-8-9-15(19)11-16(10-14)22-18(21)17(12-20)13-6-4-3-5-7-13;/h3-7,14-17,20H,8-12H2,1-2H3;1H/q+1;/p-1/t14-,15+,16?,17?;
LabNetwork Molecule IDLN04700180
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分类

  • {SA} AN-AZ, Bioactive Small Molecules, Cell Biology

相关文献及参考

  • [2]. Nurminen ML, et al. Central inhibition of nitric oxide synthesis increases blood pressure and heart rate in anesthetized rats. Methods Find Exp Clin Pharmacol. 1997 Jan-Feb;19(1):35-41.
  • [1]. Methylatropine.
  • [1]. Methylatropine.
  • [2]. Nurminen ML, et al. Central inhibition of nitric oxide synthesis increases blood pressure and heart rate in anesthetized rats. Methods Find Exp Clin Pharmacol. 1997 Jan-Feb;19(1):35-41.

安全信息

GHS Symbol
Hazard statements
  • H302 Harmful if swallowed 吞食有害
WGK Germany3
Signal word Warning
Hazard Codes Xn,N
Safety Statements
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置；
  • S61 Avoid release to the environment. Refer to special instructions/safety data sheet 避免释放到环境中，参考特别指示/安全收据说明书；
RTECSYM3720000
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R50/53
UN Number UN 3077 9/PG 3 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURA

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraduodenal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 312 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-

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1050 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: 180,155,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 118 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NIIRDN Drugs in Japan (Ethical Drugs).  (Yakugyo Jiho Co., Ltd., Tokyo,
   Japan)  Volume(issue)/page/year: -,1172,1990

TYPE OF TEST

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 358 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NIIRDN Drugs in Japan (Ethical Drugs).  (Yakugyo Jiho Co., Ltd., Tokyo,
   Japan)  Volume(issue)/page/year: -,1172,1990

Storage condition -20

其他信息

  • MOL 文件:2870-71-5.mol
  • Sigma Aldrich:2870-71-5(sigmaaldrich)

系列性分类

  1. Functional Group 官能团索引
  2. quaternary ammonium salt
  1. Life Science 生命科学
  2. Biochemistry / Glyco-Chemistry
  3. Alkaloids
  1. Medical Research Areas
  2. GPCR & G Protein
  3. mAChR  (毒蕈碱型乙酰胆碱受体)

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