Ethanethiol,2-((4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butyl)amino)-, hydrogen sulfate (ester)

CAS 38920-53-5 MFCD01728427

化学结构图

38920-53-5
SMILES: CN1C(=O)C2=C(N=CN2CCCCNCCSS(O)(=O)=O)N(C)C1=O

化学属性

Mol. FormulaC13H21N5O5S2
Mol. Weight391.51

别名和识别编码

Chemical NameEthanethiol,2-((4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butyl)amino)-, hydrogen sulfate (ester)
Wiswesser Line NotationT56 BN DN FNVNVJ B4M2SSWQ F1 H1
Synonym 2-((4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl)amino)ethanethiol, hydrogen
Beilstein Registry Number1183428
CAS Number38920-53-5
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安全信息

RTECSKJ1053000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 15,968,1972

系列性分类

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