7-Theophyllineethanol,alpha-(N-methylnicotinamidomethyl)-, nicotinate(ester)

CAS 51920-68-4 MFCD01682263

化学结构图

51920-68-4
SMILES: CN(CC(CN1C=NC2=C1C(=O)N(C)C(=O)N2C)OC(=O)C1C=NC=CC=1)C(=O)C1=CN=CC=C1

化学属性

Mol. FormulaC23H23N7O5
Mol. Weight477.53

别名和识别编码

Chemical Name7-Theophyllineethanol,alpha-(N-methylnicotinamidomethyl)-, nicotinate(ester)
Wiswesser Line NotationT56 BN DN FNVNVJ F1 H1 B1YOV- CT6NJ&1N1&V- CT6NJ
Synonym 7-(3-(N-Methylnicotinamidomethyl)-2-hydroxypropyl)theophylline nicotinate Purineethanol,
Beilstein Registry Number1198171
CAS Number51920-68-4
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安全信息

RTECSXH5180000
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 460 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CHTPBA Chimica Therapeutica.  (Paris, France)  V.1-8, 1965-73.  For
   publisher information, see EJMCA5.  Volume(issue)/page/year: 8,634,1973

系列性分类


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