Niceritrol 烟酸戊四醇酯

CAS 5868-05-3 MFCD00215982

化学结构图

5868-05-3
SMILES: O=C(OCC(COC(=O)c1cccnc1)(COC(=O)c1cccnc1)COC(=O)c1cccnc1)c1cccnc1

化学属性

Mol. FormulaC29H24N4O8
Mol. Weight556.52
Melting Point162.0 to 166.0 deg-C

别名和识别编码

Chemical NameNiceritrol
Wiswesser Line NotationT6NJ CVO1X1OV- CT6NJ&1OV- CT6NJ&1OV- CT6NJ
Synonym Niceritrol {LY} Niceritrol {} {LY} Niceritrol {} {} {LY} Niceritrol {} {} {} {LY} Niceritrol {} {} {} {} {LY} Niceritrol {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Niceritrol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Niceritrol
CAS Number5868-05-3
Beilstein Registry Number0377170
Reaxys-RN377170
Chemical Name Translation烟酸戊四醇酯
MDL NumberMFCD00215982
PubChem Substance ID354333980
Merck Number6497
LabNetwork Molecule IDLN04694324
InChIInChI=1S/C29H24N4O8/c34-25(21-5-1-9-30-13-21)38-17-29(18-39-26(35)22-6-2-10-31-14-22,19-40-27(36)23-7-3-11-32-15-23)20-41-28(37)24-8-4-12-33-16-24/h1-16H,17-20H2
Canonical SMILESO=C(C1=CC=CN=C1)OCC(COC(C2=CC=CN=C2)=O)(COC(C3=CC=CN=C3)=O)COC(C4=CC=CN=C4)=O
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安全信息

RTECSQT1980000 
TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >10 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   OYYAA2 Oyo Yakuri.  Pharmacometrics.  (Oyo Yakuri Kenkyukai, CPO Box 180,
   Sendai 980-91, Japan) V.1-    1967-  Volume(issue)/page/year: 14,741,1977

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >20 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   OYYAA2 Oyo Yakuri.  Pharmacometrics.  (Oyo Yakuri Kenkyukai, CPO Box 180,
   Sendai 980-91, Japan) V.1-    1967-  Volume(issue)/page/year: 14,741,1977

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   OYYAA2 Oyo Yakuri.  Pharmacometrics.  (Oyo Yakuri Kenkyukai, CPO Box 180,
   Sendai 980-91, Japan) V.1-    1967-  Volume(issue)/page/year: 14,741,1977

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   OYYAA2

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Mammal - dog
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   OYYAA2 Oyo Yakuri.  Pharmacometrics.  (Oyo Yakuri Kenkyukai, CPO Box 180,
   Sendai 980-91, Japan) V.1-    1967-  Volume(issue)/page/year: 14,741,197

Storage condition

系列性分类

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