Warfarin acetate

CAS 5979-00-0 MFCD05979000

化学结构图

5979-00-0
SMILES: CC(=O)CC(c1ccccc1)c1c(OC(C)=O)c2ccccc2oc1=O

化学属性

Mol. Weight350.39
Mol. FormulaC21H18O5

别名和识别编码

Chemical NameWarfarin acetate
Synonym 4-(Acetyloxy)-3-(3-oxo-1-phenylbutyl)-2H-1-benzopyran-2-one Coumarin, 3-(alpha-acetonylbenzyl)-4-hydroxy-, acetate Warfarin acetate 4-Acetoxy-3-(3-oxo-1-phenylbutyl)-2H-1-benzopyran-2-one
CAS Number5979-00-0
InChIKeyAZJMOTKZYSVMRV-UHFFFAOYSA-N
PubChem Substance ID62926
InChIInChI=1S/C21H18O5/c1-13(22)12-17(15-8-4-3-5-9-15)19-20(25-14(2)23)16-10-6-7-11-18(16)26-21(19)24/h3-11,17H,12H2,1-2H3
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安全信息

RTECSDJ2976670 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique.
   (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France)
   V.9-    1974-  Volume(issue)/page/year: 30,531,1995

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1480 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique.
   (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France)
   V.9-    1974-  Volume(issue)/page/year: 30,531,1995

系列性分类

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