HRID1202200

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

结构：CC(C)Oc1ccc(COc2ccc3c(c2)c(I)c2n3CCC2CC(=O)OC(C)(C)C)cc1C(F)(F)F

HCID67251011

未命名化合物

HCID178477796

未命名化合物

PRODUCTS

生成物

结构：Cc1c2n(c3ccc(OCc4ccc(OC(C)C)c(C(F)(F)F)c4)cc13)CCC2CC(=O)OC(C)(C)C

HCID67249074

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1324771fda514c9988da2d68bdf12b30
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:38][Zn:39][CH3:40].[I:1][c:2]1[c:3]2[n:4]([c:5]3[cH:6][cH:7][c:8]([O:11][CH2:12][c:13]4[cH:14][c:15]([C:23]([F:24])([F:25])[F:26])[c:16]([O:19][CH:20]([CH3:21])[CH3:22])[cH:17][cH:18]4)[cH:9][c:10]13)[CH2:27][CH2:28][CH:29]2[CH2:30][C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37]>>[c:2]1([CH3:38])[c:3]2[n:4]([c:5]3[cH:6][cH:7][c:8]([O:11][CH2:12][c:13]4[cH:14][c:15]([C:23]([F:24])([F:25])[F:26])[c:16]([O:19][CH:20]([CH3:21])[CH3:22])[cH:17][cH:18]4)[cH:9][c:10]13)[CH2:27][CH2:28][CH:29]2[CH2:30][C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37]