Simetride 西美曲特

CAS 154-82-5 MFCD00864291

化学结构图

154-82-5
SMILES: CCCc1ccc(OCC(=O)N2CCN(C(=O)COc3ccc(CCC)cc3OC)CC2)c(OC)c1

化学属性

Mol. FormulaC28H38N2O6
Mol. Weight498.68

别名和识别编码

Chemical NameSimetride
Wiswesser Line NotationT6N DNTJ AV1OR D3 BO1& DV1OR D3 BO1
Synonym Simetride 1,4-Bis((2-methoxy-4-propylphenoxy)acetyl)piperazine Kyorin AP 2 AP 2
CAS Number154-82-5
Beilstein Registry Number0772468
PubChem Substance ID71622
InChIInChI=1S/C28H38N2O6/c1-5-7-21-9-11-23(25(17-21)33-3)35-19-27(31)29-13-15-30(16-14-29)28(32)20-36-24-12-10-22(8-6-2)18-26(24)34-4/h9-12,17-18H,5-8,13-16,19-20H2,1-4H3
Chemical Name Translation西美曲特
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安全信息

RTECSTK9700000
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >1 gm/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: 85,715,1965

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >1025 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NIIRDN Drugs in Japan (Ethical Drugs).  (Yakugyo Jiho Co., Ltd., Tokyo,
   Japan)  Volume(issue)/page/year: 6,206,1982

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 12 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   85IPAE "Modern Pharmaceuticals of Japan, III," Tokyo, Japan Pharmaceutical,
   Medical and Dental Supply Exporters' Assoc.,  1968 Volume(issue)/page/year:
   -,84,1968

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