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【结 构 式】

【分子编号】52410

【品名】 

【CA登记号】

【 分 子 式 】C40H60O13

【 分 子 量 】748.9086

【元素组成】C 64.15% H 8.08% O 27.77%

与该中间体有关的原料药合成路线共 2 条

合成路线1

该中间体在本合成路线中的序号:(XLVII)

Cyclization between the aldehyde and vinyl iodide moieties of (XXXVIII) was achieved by NiCl2/CrCl2-promoted intramolecular condensation. The resulting macrocyclic alcohol (XLV) was then oxidized to ketone (XLVI) with Dess-Martin periodinane reagent. Deprotection of (XLVI) with tetrabutylammonium fluoride furnished the fully desilylated compound (XLVII). The final cyclization between hydroxyl groups and the unsaturated ketone group of (XLVII) under acidic conditions gave rise to the title compound.

1 Littlefield, B.A.; Zheng, W.; Seletsky, B.M.; Yu, M.J.; Palme, M.H.; Towle, M.J. (Eisai Co., Ltd.); Macrocyclic analogs and methods of their use and preparation. US 6214865; WO 9965894 .
中间体序号 中间体编号 品名 CAS号 分子式 供应商 用于合成
(XLVa) 52407   C70H132O13Si5 详情 详情
(XLVb) 52408   C70H132O13Si5 详情 详情
(XXXVIII) 52400   C70H131IO13Si5 详情 详情
(XLVI) 52409   C70H130O13Si5 详情 详情
(XLVII) 52410   C40H60O13 详情 详情

合成路线2

该中间体在本合成路线中的序号:(XLVII)

Cyclization between the aldehyde and vinyl iodide moieties of (XXXVIII) was achieved by NiCl2/CrCl2-promoted intramolecular condensation. The resulting macrocyclic alcohol (XLV) was then oxidized to ketone (XLVI) with Dess-Martin periodinane reagent. Deprotection of (XLVI) with tetrabutylammonium fluoride furnished the fully desilylated compound (XLVII). Then, cyclization between hydroxyl groups and the unsaturated ketone groups of (XLVII) under acidic conditions gave rise to the polycyclic compound (XLVIII).

1 Littlefield, B.A.; Zheng, W.; Seletsky, B.M.; Yu, M.J.; Palme, M.H.; Towle, M.J. (Eisai Co., Ltd.); Macrocyclic analogs and methods of their use and preparation. US 6214865; WO 9965894 .
中间体序号 中间体编号 品名 CAS号 分子式 供应商 用于合成
(XLVa) 52407   C70H132O13Si5 详情 详情
(XLVb) 52408   C70H132O13Si5 详情 详情
(XXXVIII) 52400   C70H131IO13Si5 详情 详情
(XLVI) 52409   C70H130O13Si5 详情 详情
(XLVII) 52410   C40H60O13 详情 详情
(XLVIII) 52424 20-(2,3-dihydroxypropyl)-14-methyl-8,15-dimethylidene-21-(methyloxy)-2,19,30,34,37,39,40,41-octaoxanonacyclo[24.9.2.1~3,32~.1~3,33~.1~6,9~.1~12,16~.0~18,22~.0~29,36~.0~31,35~]hentetracontan-24-one C40H58O12 详情 详情
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