4,5'-Dimethylangelicin

CAS 4063-41-6 MFCD01725704

化学结构图

4063-41-6
SMILES: Cc1cc2c(ccc3c(C)cc(=O)oc32)o1

化学属性

Mol. FormulaC13H10O3
Mol. Weight214.23

别名和识别编码

Chemical Name4,5'-Dimethylangelicin
InChIKeyPFFGIQUVLUEURV-UHFFFAOYSA-N
Wiswesser Line NotationT B566 EO LOVJ D1 J1
Synonym 4',4-Dimethylangelicin 4,5'-Dimethyl angelicin 4,5'-dimethylangelicin 4,8-Dimethyl-2H-furo(2,3-h)-1-benzopyran-2-one 4,8-Dimethylisopsoralen 5-Benzofuranacrylic acid, 4-hydroxy-beta,2-dimethyl-, delta-lactone
CAS Number4063-41-6
Beilstein Registry Number0189530
PubChem Substance ID61322
InChIInChI=1S/C13H10O3/c1-7-5-12(14)16-13-9(7)3-4-11-10(13)6-8(2)15-11/h3-6H,1-2H3
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安全信息

RTECSLV1051000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 2500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   USXXAM United States Patent Document.  (U.S. Patent Office, Box 9,
   Washington, DC 20231)  Volume(issue)/page/year: #4312883

系列性分类

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