HRID311547

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID231201

2-phenyl-2-(2,4,6-trimethylphenyl)acetic acid

C17H18O2

HCID21957142

未命名化合物

PRODUCTS

生成物

结构：CCC(=O)Nc1cccc(C2CCN(CCCNC(=O)C(c3ccccc3)c3c(C)cc(C)cc3C)CC2)c1

HCID21957246

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-499f9f31e6414bcd9069b58195e2a12b
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

[NH2:20][CH2:21][CH2:22][CH2:23][N:24]1[CH2:25][CH2:26][CH:27]([c:30]2[cH:31][c:32]([NH:36][C:37]([CH2:38][CH3:39])=[O:40])[cH:33][cH:34][cH:35]2)[CH2:28][CH2:29]1.[c:1]1([CH3:19])[c:2]([CH:9]([C:10](=[O:11])[OH:12])[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[c:3]([CH3:8])[cH:4][c:5]([CH3:7])[cH:6]1>>[c:1]1([CH3:19])[c:2]([CH:9]([C:10](=[O:11])[NH:20][CH2:21][CH2:22][CH2:23][N:24]2[CH2:25][CH2:26][CH:27]([c:30]3[cH:31][c:32]([NH:36][C:37]([CH2:38][CH3:39])=[O:40])[cH:33][cH:34][cH:35]3)[CH2:28][CH2:29]2)[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[c:3]([CH3:8])[cH:4][c:5]([CH3:7])[cH:6]1