HCID86588531

Ethyl 11-[3,17beta-bis(benzyloxy)estra-1,3,5(10), 9(11)-tetraen-11-yl]-2-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)-9-undecenoate

ethyl 11-[(8S,13S,14S,17S)-13-methyl-3,17-bis(phenylmethoxy)-6,7,8,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-11-yl]-2-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)undec-9-enoate

C51H59F9O4907 g/mol

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IDENTITY

结构与身份

标准 SMILES: CCOC(=O)C(CCCCCCC=CCC1=C2c3ccc(OCc4ccccc4)cc3CC[C@H]2[C@@H]2CC[C@H](OCc3ccccc3)[C@@]2(C)C1)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIKey: ROORRYAKWSUMRD-ZZCCVNICSA-N
分子式: C51H59F9O4
平均分子量: 907 g/mol
单同位素质量: 906.42696382

COMPUTED

结构计算性质

已同步

XLogP: 14.5
极性表面积: 44.8 Å²
氢键供体: 0
氢键受体: 13
可旋转键: 23
重原子: 64
形式电荷: 0
复杂度: 1,530

ALIASES

名称与别名

共 3 条

ethyl 11-[3,17beta-bis(benzyloxy)estra-1,3,5(10), 9(11)-tetraen-11-yl]-2-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)-9-undecenoateEthyl 11-[3,17beta-bis(benzyloxy)estra-1,3,5(10),9(11)-tetraen -11-yl]-2-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)-9-undecenoateethyl 11-[3,17beta-bis(benzyloxy)estra-1,3,5(10),9(11)-tetraen-11-yl]-2-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)-9-undecenoate

REACTIONS