Tropine 4-tolylacetate methiodide

CAS 5135-79-5 MFCD05135795

化学结构图

5135-79-5
SMILES: Cc1ccc(CC(=O)OC2CC3CCC(C2)[N+]3(C)C)cc1.[I-]

化学属性

Mol. Weight415.35
Mol. FormulaC18H26NO2.I

别名和识别编码

Wiswesser Line NotationT56 A AKTJ A1 A1 GOV1R D1 &I
Chemical NameTropine 4-tolylacetate methiodide
Synonym 8-Azoniabicyclo (3.2.1)octane, 8,8-dimethyl-3-((4-methylbenzoyl)oxy)-, tropine 4-tolylacetate methiodide tropine p-tolylacetate methiodide
CAS Number5135-79-5
InChIKeyYHIYMHZGIATCDV-UHFFFAOYSA-M
PubChem Substance ID197821
InChIInChI=1S/C18H26NO2.HI/c1-13-4-6-14(7-5-13)10-18(20)21-17-11-15-8-9-16(12-17)19(15,2)3;/h4-7,15-17H,8-12H2,1-3H3;1H/q+1;/p-1
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安全信息

RTECSYM3751600 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Mammal - cat
DOSE/DURATION           : 20 mg/kg
TOXIC EFFECTS :
   Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation)
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - rigidity (including catalepsy)
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   9,240,1966

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 28 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - changes in motor activity (specific assay)
   Lungs, Thorax, or Respiration - respiratory obstruction
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   9,240,1966

系列性分类

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