Aspergillic acid

CAS 490-02-8 MFCD00597205

化学结构图

490-02-8
SMILES: CCC(C)c1cnc(CC(C)C)c(=O)n1O

化学属性

Mol. FormulaC12H20N2O2
Mol. Weight224.34

别名和识别编码

Chemical NameAspergillic acid
Wiswesser Line NotationT6N DNJ AO BQ C1Y1&1 EY2&1
Synonym 6-sec-Butyl-1-hydroxy-3-isobutyl-2(1H)-pyrazinone Granegillin 6-sec-Butyl-3-isobutyl pyrazinol 1-oxide 2-Hydroxy-3-isobutyl-6-(1-methylpropyl)pyrazine 1-oxide 2(1H)-Pyrazinone, 6-sec-butyl-1-hydroxy-3-isobutyl- 1-Hydroxy-6-(1-methylpropyl)-3-(2-methylpropyl)-2(1H)-pyrazinone 3-Isobutyl-6-sec-butyl-2-hydroxypyrazine 1-oxide 2(1H)-Pyrazinone, 1-hydroxy-6-(1-methylpropyl)-3-(2-methylpropyl)- (+)- Pyrazinol, 6-sec-butyl-3-isobutyl-, 1-oxide
Beilstein Registry Number0882390
CAS Number490-02-8
PubChem Substance ID10272
InChIInChI=1S/C12H20N2O2/c1-5-9(4)11-7-13-10(6-8(2)3)12(15)14(11)16/h7-9,16H,5-6H2,1-4H3
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安全信息

RTECSCI9625000 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 200 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JOBAAY Journal of Bacteriology.  (American Soc. for Microbiology, 1913 I
   St., NW, Washington, DC 20006)  V.1-    1916-  Volume(issue)/page/year:
   45,433,1943

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 150 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
REFERENCE :
   JOBAAY Journal of Bacteriology.  (American Soc. for Microbiology, 1913 I
   St., NW, Washington, DC 20006)  V.1-    1916-  Volume(issue)/page/year:
   45,433,1943

系列性分类

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