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

CAS 38920-54-6 MFCD01728428

化学结构图

38920-54-6
SMILES: CN1C2N=CN(C)C=2C(=O)N(CCCCNCCSS(O)(=O)=O)C1=O

化学属性

Mol. FormulaC13H21N5O5S2
Mol. Weight391.51

别名和识别编码

Chemical NameEthanethiol,2-((4-(3,7-dimethyl-2,6-dioxopurin-1-yl)butyl)amino)-, hydrogen sulfate (ester)
Wiswesser Line NotationT56 BN DN FNVNVJ B1 F1 H4M2SSWQ
Synonym 2-((4-(3,7-Dimethyl-2,6-dioxopurin-1-yl)butyl)amino)ethanethiol, hydrogen
Beilstein Registry Number1182508
CAS Number38920-54-6
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安全信息

RTECSKJ1054000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 130 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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