HRID204331

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8058

Hexane

C6H14

HCID8857

Ethyl Acetate

C4H8O2

HCID2795359

4-Morpholinophenylboronic acid

C10H14BNO3

HCID57885895

未命名化合物

PRODUCTS

产物

HCID57885904

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-c947ab556e6244238a8e3b2ba8917ee6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应SMILES

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