HRID113463

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

结构：CCOC(=O)C(Cc1ccc(OCC=C(C)c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2)cc1)OCC

HCID178471031

未命名化合物

PRODUCTS

生成物

结构：CCOC(Cc1ccc(OCC=C(C)c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2)cc1)C(=O)O

HCID87999018

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-12c26d1fc1664a57841c5a6d621df15b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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