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【结 构 式】

【分子编号】59438

【品名】 

【CA登记号】

【 分 子 式 】C23H30BF4IrO2

【 分 子 量 】617.5116128

【元素组成】C 44.74% H 4.9% B 1.75% F 12.31% Ir 31.13% O 5.18%

与该中间体有关的原料药合成路线共 1 条

合成路线1

该中间体在本合成路线中的序号:(XXXIVb)

In a further procedure, estradiol (I) was complexed with in situ prepared [Cp*Ir(acetone)3][BF4]2 to afford, after deprotonation with Et3N, the dienone-iridium complex (XXXIVa-b) as a mixture of alpha and beta isomers. The major alpha isomer was isolated by fractional crystallization and subsequently treated with sodium methoxide in MeOH at -40 C to furnish selectively the 2-methoxy adduct (XXXV). Subsequent oxidative decomplexation with iodine in acetonitrile provided the target 2-methoxyestradiol.

1 Le Bras, J.; et al.; Activation and regioselective ortho-functionalization of the A-ring of beta-estradiol promoted by "Cp*Ir": An efficient organometallic procedure for the synthesis of 2-methoxyestradiol. Organometallics 1997, 16, 8, 1765.
中间体序号 中间体编号 品名 CAS号 分子式 供应商 用于合成
(XXXIVa) 59437   C23H30BF4IrO2 详情 详情
(XXXIVb) 59438   C23H30BF4IrO2 详情 详情
(I) 34210 (8R,9S,13S,14S,17S)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol 50-28-2 C18H24O2 详情 详情
(XXX) 59439   C24H32IrO3 详情 详情
Extended Information