Ethoheptazine citrate

CAS 6700-56-7 MFCD06700567

化学结构图

6700-56-7
SMILES: CCOC(=O)C1(c2ccccc2)CCCN(C)CC1.O=C(O)CC(O)(CC(=O)O)C(=O)O

化学属性

Mol. Weight1606.38
Mol. FormulaC16H23NO2.xC6H8O7

别名和识别编码

Chemical NameAzepine-4-carboxylic acid,hexahydro-1-methyl-4-phenyl-, ethyl ester, citrate
Synonym Zactane citrate 1-Methyl-1-carbethoxy-4-phenyl hexamethylenimine citrate Ethoheptazine citrate
Wiswesser Line NotationT7NTJ A1 DVO2 DR &QV1XQVQ1VQ
CAS Number6700-56-7
PubChem Substance ID23165
InChIInChI=1S/C16H23NO2.C6H8O7/c1-3-19-15(18)16(14-8-5-4-6-9-14)10-7-12-17(2)13-11-16;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-6,8-9H,3,7,10-13H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
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安全信息

RTECSCM2975000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 217 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
REFERENCE :
   PLRCAT Pharmacological Research Communications.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802)  V.1-    1969-  Volume(issue)/page/year:
   2,39,1970

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 580 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 134,332,1961

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 156 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
REFERENCE :
   PLRCAT Pharmacological Research Communications.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802)  V.1-    1969-  Volume(issue)/page/year:
   2,39,1970

系列性分类

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