Barbituric acid, 1-(4-hydroxycyclohexyl)-5-pentyl-, acetate (ester)

CAS 4394-22-3 MFCD N/A

化学结构图

4394-22-3
SMILES: CCCCC[C@H]1C(=O)NC(=O)N(C2CCC(OC(C)=O)CC2)C1=O

化学属性

Mol. FormulaC17H26N2O5
Mol. Weight338.45

别名和识别编码

Chemical NameBarbituric acid, 1-(4-hydroxycyclohexyl)-5-pentyl-, acetate (ester)
Chemicalbook IDCB82399083
Synonym 1-(4-Hydroxycyclohexyl)-5-pentylbarbituric acid acetate (ester)
CAS Number4394-22-3
Beilstein Registry Number0708743
InChIKeyTVOSRCWHNOKHEY-UHFFFAOYSA-N
PubChem Substance ID199551
InChIInChI=1S/C17H26N2O5/c1-3-4-5-6-14-15(21)18-17(23)19(16(14)22)12-7-9-13(10-8-12)24-11(2)20/h12-14H,3-10H2,1-2H3,(H,18,21,23)
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安全信息

RTECSCQ7070800 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1650 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   YKKZAJ Yakugaku Zasshi.  Journal of Pharmacy.  (Nippon Yakugakkai, 2-12-15
   Shibuya, Shibuya-ku, Tokyo 150, Japan)  No.1-    1881-
   Volume(issue)/page/year: 89,254,1969

系列性分类

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