Cytisinium, N,N-dimethyl-, iodide

CAS 5853-05-4 MFCD05853054

化学结构图

5853-05-4
SMILES: COc1ccc(CCNC(=O)c2ccc(C#CC(C)(C)O)cc2)cc1OC

化学属性

Mol. Weight346.24
Mol. FormulaC13H19N2O.I

别名和识别编码

Wiswesser Line NotationT C666 A GVN LK&TTJ L1 L1 &Q &I
Chemical NameCytisinium, N,N-dimethyl-, iodide
Synonym (-)-7R:9S-Caulophylline methiodide (-)-Caulophylline methyl iodide
CAS Number5853-05-4
InChIKeyVLKBCUWKDBHUFH-UHFFFAOYSA-M
PubChem Substance ID1372995
InChIInChI=1S/C22H25NO4/c1-22(2,25)13-11-16-5-8-18(9-6-16)21(24)23-14-12-17-7-10-19(26-3)20(15-17)27-4/h5-10,15,25H,12,14H2,1-4H3,(H,23,24)
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安全信息

RTECSHA4900000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >2770 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - muscle contraction or spasticity
REFERENCE :
   BJPCBM British Journal of Pharmacology.  (Macmillan Press Ltd., Houndmills,
   Basingstoke, Hants. RG21 2XS, UK)  V.34-    1968-  Volume(issue)/page/year:
   35,161,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >692 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - muscle contraction or spasticity
REFERENCE :
   BJPCBM British Journal of Pharmacology.  (Macmillan Press Ltd., Houndmills,
   Basingstoke, Hants. RG21 2XS, UK)  V.34-    1968-  Volume(issue)/page/year:
   35,161,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 61 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - rigidity (including catalepsy)
REFERENCE :
   BJPCBM British Journal of Pharmacology.  (Macmillan Press Ltd., Houndmills,
   Basingstoke, Hants. RG21 2XS, UK)  V.34-    1968-  Volume(issue)/page/year:
   35,161,1969

系列性分类

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