HRID823251

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2518

3,4-Dihydroxycinnamic acid

C9H8O4

结构：O=C(O)c1ccc(OCc2ccc(F)cc2)c(OCc2ccc(F)cc2)c1

HCID18627055

3,4-Bis[(4-fluorophenyl)methoxy]benzoic acid

C21H16F2O4

结构：CC(C)(C)OCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCCc1ccc(O)c(O)c1

HCID178450523

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OCC(NC(=O)c1ccc(OCc2ccc(F)cc2)c(OCc2ccc(F)cc2)c1)C(=O)NCCc1ccc(O)c(O)c1

HCID178450518

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d7cd1374b3d44b899a36b3e0dc2786fa
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH:66]([C:67](=[O:68])[OH:69])=[CH:70][c:71]1[cH:72][c:73]([OH:74])[c:75]([OH:76])[cH:77][cH:78]1.[F:39][c:40]1[cH:41][cH:42][c:43]([CH2:44][O:45][c:46]2[cH:47][c:48]([C:49]([OH:50])=[O:51])[cH:52][cH:53][c:54]2[O:55][CH2:56][c:57]2[cH:58][cH:59][c:60]([F:63])[cH:61][cH:62]2)[cH:64][cH:65]1.[cH:1]1[c:2]2[c:12]([cH:13][cH:14][cH:15]1)-[c:7]1[c:6]([cH:11][cH:10][cH:9][cH:8]1)[CH:3]2[CH2:4][O:5][C:16](=[O:17])[NH:18][CH:19]([CH2:20][O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[C:26](=[O:27])[NH:28][CH2:29][CH2:30][c:31]1[cH:32][c:33]([OH:34])[c:35]([OH:36])[cH:37][cH:38]1>>[C:16](=[O:17])([NH:18][CH:19]([CH2:20][O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[C:26](=[O:27])[NH:28][CH2:29][CH2:30][c:31]1[cH:32][c:33]([OH:34])[c:35]([OH:36])[cH:37][cH:38]1)[c:48]1[cH:47][c:46]([O:45][CH2:44][c:43]2[cH:42][cH:41][c:40]([F:39])[cH:65][cH:64]2)[c:54]([O:55][CH2:56][c:57]2[cH:58][cH:59][c:60]([F:63])[cH:61][cH:62]2)[cH:53][cH:52]1