HRID281248

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

2 次

HCID11575

Benzene, iodo-

C6H5I

结构：CCCCCCCCON1C(C)(C)CC(OC(=O)NNC(=O)OC2CC(C)(C)N(OCCCCCCCC)C(C)(C)C2)CC1(C)C

HCID15345986

未命名化合物

PRODUCTS

生成物

HCID53726438

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b614f93074c240ffa5dc73f33da68feb
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

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