HRID2162553

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11469593

3-bromoheptan-4-one

C7H13BrO

HCID12431734

1-Bromoheptan-2-one

C7H13BrO

HCID13329481

未命名化合物

PRODUCTS

生成物

HCID3164022

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cb51c49f1e164d39b12b14ffc2ae4960
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:10][CH:11]([C:12](=[O:13])[CH2:14][CH2:15][CH3:16])[CH2:17][CH3:18].[Br:19][CH:20]([CH:21]([CH3:22])[CH3:23])[C:24](=[O:25])[CH:26]([CH3:27])[CH3:28].[Br:1][CH2:2][C:3](=[O:4])[CH2:5][CH2:6][CH2:7][CH2:8][CH3:9].[NH2:29][c:30]1[s:31][cH:32][c:33]([CH2:34][CH2:35][CH2:36][CH2:37][CH3:38])[n:39]1.[NH2:40][c:41]1[s:42][c:43]([CH2:48][CH2:49][CH3:50])[c:44]([CH2:46][CH3:47])[n:45]1.[NH2:51][c:52]1[s:53][c:54]([CH:55]([CH3:56])[CH3:57])[c:58]([CH:59]([CH3:60])[CH3:61])[n:62]1>>[NH2:40][c:41]1[s:42][c:43]([CH3:48])[c:44]([CH2:46][CH3:47])[n:45]1