3-Hydroxy-8-propyl-1-alpha-H,5-alpha-H-tropanium bromide benzilate

CAS 2486-99-9 MFCD01677497

化学结构图

2486-99-9
SMILES: CCC[N+]1(C)C2CCC1CC(OC(=O)C(O)(c1ccccc1)c1ccccc1)C2.[Br-]

化学属性

Mol. FormulaC25H32NO3.Br
Mol. Weight474.49

别名和识别编码

Chemical Name1-alpha-H,5-alpha-H-Tropanium, 3-hydroxy-8-propyl-, bromide benzilate
Wiswesser Line NotationT56 A AKTJ A3 A1 DOVXQR&R &E
Synonym 3-Hydroxy-8-propyl-1-alpha-H,5-alpha-H-tropanium bromide benzilate
CAS Number2486-99-9
InChIKeyTXLAKDIEDKPHEF-UHFFFAOYSA-M
PubChem Substance ID200667
InChIInChI=1S/C25H32NO3.BrH/c1-3-16-26(2)21-14-15-22(26)18-23(17-21)29-24(27)25(28,19-10-6-4-7-11-19)20-12-8-5-9-13-20;/h4-13,21-23,28H,3,14-18H2,1-2H3;1H/q+1;/p-1
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安全信息

RTECSYM3780000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 225 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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