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【结 构 式】 
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【分子编号】47058 【品名】(1R,9S,12S,13R,14S,17R,21S,23S,24R,25S,27R)-17-allyl-12-((E)-2-[(1R,3R,4R)-4-[(chlorocarbonyl)oxy]-3-methoxycyclohexyl]-1-methylethenyl)-1,14-dihydroxy-23,25-dimethoxy-13,19,21,27-tetramethyl-2,3,10,16-tetraoxo-11,28-dioxa-4-azatricyclo[22.3.1.0(4,9)]octacos-18-ene 【CA登记号】 |
【 分 子 式 】C45H68ClNO13 【 分 子 量 】866.48656 【元素组成】C 62.38% H 7.91% Cl 4.09% N 1.62% O 24% |
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：(II)The title carbamate was prepared by treatment of the ascomycin derivative (I) with triphosgene and dimethylaminopyridine at -77 C, followed by condensation of the intermediate chloroformate (II) with methyl 4-aminophenylacetate (III).
| 【1】 Naef, R.; Hersperger, R. (Novartis AG; Novartis Deutschland GmbH); Ascomycins. JP 2000505044; US 5925649; WO 9631514 . |
| 中间体序号 | 中间体编号 | 品名 | CAS号 | 分子式 | 供应商 | 用于合成 |
|---|---|---|---|---|---|---|
| (I) | 47057 | (1R,9S,12S,13R,14S,17R,21S,23S,24R,25S,27R)-17-allyl-1,14-dihydroxy-12-[(E)-2-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]-1-methylethenyl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.0(4,9)]octacos-18-ene-2,3,10,16-tetrone | C44H69NO12 | 详情 | 详情 | |
| (II) | 47058 | (1R,9S,12S,13R,14S,17R,21S,23S,24R,25S,27R)-17-allyl-12-((E)-2-[(1R,3R,4R)-4-[(chlorocarbonyl)oxy]-3-methoxycyclohexyl]-1-methylethenyl)-1,14-dihydroxy-23,25-dimethoxy-13,19,21,27-tetramethyl-2,3,10,16-tetraoxo-11,28-dioxa-4-azatricyclo[22.3.1.0(4,9)]octacos-18-ene | C45H68ClNO13 | 详情 | 详情 | |
| (III) | 47059 | methyl 2-(4-aminophenyl)acetate | C9H11NO2 | 详情 | 详情 |
Extended Information