HRID289802

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8487

3-Hydroxyacetophenone

C8H8O2

结构：CC(C)C(=O)Nc1cccc(C2CCN(CCCCCC(O)c3ccccc3)CC2)c1

HCID22049151

未命名化合物

PRODUCTS

生成物

结构：CC(=O)c1cccc(OC(CCCCCN2CCC(c3cccc(NC(=O)C(C)C)c3)CC2)c2ccccc2)c1

HCID22049511

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-49568ac88a914ab198760cd849a5bc2f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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