3-(2-(Diethylamino)ethyl)-5-methylisoxazole citrate

CAS 971-71-1 MFCD N/A

化学结构图

971-71-1
SMILES: CC[NH+](CC)CCc1cc(C)on1.O=C(O)CC(O)(CC(=O)O)C(=O)[O-]

化学属性

Mol. Weight374.44
Mol. FormulaC10H18N2O.C6H8O7

别名和识别编码

Wiswesser Line NotationT5NOJ C1 E2N2&2 &QV1XQVQ1VQ
Chemical NameIsoxazole, 3-(2-(diethylamino)ethyl)-5-methyl-, citrate (1:1)
Synonym 3-(2-(Diethylamino)ethyl)-5-methylisoxazole citrate
CAS Number971-71-1
InChIKeyVCXGQCILUVIUMB-UHFFFAOYSA-N
PubChem Substance ID13779
InChIInChI=1S/C10H18N2O.C6H8O7/c1-4-12(5-2)7-6-10-8-9(3)13-11-10;7-3(8)1-6(13,5(11)12)2-4(9)10/h8H,4-7H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
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安全信息

RTECSNY2762000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 614 mg/kg
TOXIC EFFECTS :
   Behavioral - analgesia
   Nutritional and Gross Metabolic - body temperature decrease
   Biochemical - Metabolism (Intermediary) - effect on inflammation or
   mediation of inflammation
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 10,411,1967

系列性分类

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