HRID688583

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID115197

Dimethyldioxirane

C3H6O2

结构：CCCCCCCCCCCC(=O)OC1CC(c2ccccc2)NC(c2ccccc2)C1

HCID15250484

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCCCCC(=O)OC1CC(c2ccccc2)N(O)C(c2ccccc2)C1

HCID54494783

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-71cb5ce85cb54bdea7c8179f272f1e42
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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