HRID1210055

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2734624

4-Hydroxyphenylboronic acid pinacol ester

C12H17BO3

HCID2734706

4-(Hydroxymethyl)phenylboronic acid

C7H9BO3

结构：CCOC(=O)c1nc(N2CCc3cccc(C(=O)N(COCC[Si](C)(C)C)c4nc5ccccc5s4)c3C2)sc1-c1ccc(CO)cc1

HCID59447480

未命名化合物

HCID59447642

未命名化合物

PRODUCTS

生成物

HCID59447503

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c3bae19bb81441e980e66f4ac1702337
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

[Br:60][c:61]1[cH:62][s:63][c:64]2[c:65]1[n:66][cH:67][n:68][c:69]2[NH:70][CH:71]([CH3:72])[CH3:73].[CH3:74][C:75]1([CH3:76])[C:77]([CH3:78])([CH3:79])[O:80][B:81]([c:82]2[cH:83][cH:84][c:85]([OH:88])[cH:86][cH:87]2)[O:89]1.[OH:49][CH2:50][c:51]1[cH:52][cH:53][c:54]([B:55]([OH:56])[OH:57])[cH:58][cH:59]1.[s:1]1[c:2]2[cH:3][cH:4][cH:5][cH:6][c:7]2[n:8][c:9]1[N:10]([CH2:11][O:12][CH2:13][CH2:14][Si:15]([CH3:16])([CH3:17])[CH3:18])[C:19]([c:20]1[cH:21][cH:22][cH:23][c:24]2[c:25]1[CH2:26][N:27]([c:28]1[s:29][c:30](-[c:31]3[cH:32][cH:33][c:34]([CH2:35][OH:36])[cH:37][cH:38]3)[c:39]([C:40]([O:41][CH2:42][CH3:43])=[O:44])[n:45]1)[CH2:46][CH2:47]2)=[O:48]>>[c:61]1(-[c:82]2[cH:83][cH:84][c:85]([OH:88])[cH:86][cH:87]2)[cH:62][s:63][c:64]2[c:65]1[n:66][cH:67][n:68][c:69]2[NH:70][CH:71]([CH3:72])[CH3:73]