HRID2348904

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID59190376

未命名化合物

结构：CC(c1ccc(B2OC(C)(C)C(C)(C)O2)cc1)N1CCC(CC(C)(C)O)(c2ccccc2F)OC1=O

HCID72344432

6-(2-Fluorophenyl)-6-(2-hydroxy-2-methylpropyl)-3-[1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one

C28H37BFNO5

PRODUCTS

生成物

结构：CC(c1ccc(-c2ccn(C3CC3)c(=O)c2)cc1)N1CCC(CC(C)(C)O)(c2ccccc2F)OC1=O

HCID75092421

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-81ffab0b83824ac898f663b870c47350
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH:37]1([n:40]2[c:41](=[O:47])[cH:42][c:43]([I:46])[cH:44][cH:45]2)[CH2:38][CH2:39]1.[F:1][c:2]1[c:3]([C:8]2([CH2:32][C:33]([CH3:34])([CH3:35])[OH:36])[CH2:9][CH2:10][N:11]([CH:15]([CH3:16])[c:17]3[cH:18][cH:19][c:20]([B:23]4[O:24][C:25]([CH3:26])([CH3:27])[C:28]([CH3:29])([CH3:30])[O:31]4)[cH:21][cH:22]3)[C:12](=[O:14])[O:13]2)[cH:4][cH:5][cH:6][cH:7]1>>[F:1][c:2]1[c:3]([C:8]2([CH2:32][C:33]([CH3:34])([CH3:35])[OH:36])[CH2:9][CH2:10][N:11]([CH:15]([CH3:16])[c:17]3[cH:18][cH:19][c:20](-[c:43]4[cH:42][c:41](=[O:47])[n:40]([CH:37]5[CH2:38][CH2:39]5)[cH:45][cH:44]4)[cH:21][cH:22]3)[C:12](=[O:14])[O:13]2)[cH:4][cH:5][cH:6][cH:7]1