gamma-Thujaplicin

CAS 672-76-4 MFCD01734418

化学结构图

672-76-4
SMILES: CC(C)c1ccc(O)c(=O)cc1

化学属性

Mol. FormulaC10H12O2
Mol. Weight164.22

别名和识别编码

Chemical Namegamma-Thujaplicin
Synonym 2-Hydroxy-5-isopropyl-2,4,6-cycloheptatrien-1-one gamma-Thujaplicin 2,4,6-Cycloheptatrien-1-one, 2-hydroxy-5-isopropyl- gamma-Thujaplicine
Wiswesser Line NotationL7VJ BQ EY1&1
CAS Number672-76-4
Beilstein Registry Number2044323
InChIKeyWKEWHSLZDDZONF-UHFFFAOYSA-N
LabNetwork Molecule IDLN04633609
PubChem Substance ID12649
InChIInChI=1S/C10H12O2/c1-7(2)8-3-5-9(11)10(12)6-4-8/h3-7H,1-2H3,(H,11,12)
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安全信息

RTECSGU4580000 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Amphibian - frog
DOSE/DURATION           : 100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JAPMA8 Journal of the American Pharmaceutical Association, Scientific
   Edition.  (Washington, DC) V.29-49, 1940-60.  For publisher information, see
   JPMSAE.  Volume(issue)/page/year: 48,722,1959

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 162 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JAPMA8 Journal of the American Pharmaceutical Association, Scientific
   Edition.  (Washington, DC) V.29-49, 1940-60.  For publisher information, see
   JPMSAE.  Volume(issue)/page/year: 48,722,1959

系列性分类

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