1-alpha-H,5-alpha-H-Tropanium, 8-ethyl-3-hydroxy-, bromide, benzilate

CAS 2698-27-3 MFCD01677512

化学结构图

2698-27-3
SMILES: CC[N+]1(C)[C@H]2CC[C@@H]1CC(OC(=O)C(O)(c1ccccc1)c1ccccc1)C2.[Br-]

化学属性

Mol. FormulaC24H30NO3.Br
Mol. Weight460.46

别名和识别编码

Chemical Name1-alpha-H,5-alpha-H-Tropanium, 8-ethyl-3-hydroxy-, bromide, benzilate
InChIKeyZFFMMXQZPXYZPW-UHFFFAOYSA-M
Wiswesser Line NotationT56 A AKTJ A2 A1 DOVXQR&R &E
Synonym 8-Ethyl-3-hydroxy-1-alpha-H,5-alpha-H-tropanium bromide benzilate
CAS Number2698-27-3
PubChem Substance ID200776
InChIInChI=1S/C24H30NO3.BrH/c1-3-25(2)20-14-15-21(25)17-22(16-20)28-23(26)24(27,18-10-6-4-7-11-18)19-12-8-5-9-13-19;/h4-13,20-22,27H,3,14-17H2,1-2H3;1H/q+1;/p-1
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安全信息

RTECSYM3678000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 135 mg/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: 7,217,1957

系列性分类

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