HRID106760

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID53397489

未命名化合物

结构：CCOC(OCC)C(C)N(Cc1cccc2cccnc12)C(=O)C(N)CC(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1

HCID178471484

未命名化合物

PRODUCTS

生成物

结构：CCOC(OCC)C(C)N(Cc1cccc2cccnc12)C(=O)C(CC(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)CN(C)NC(=O)NCc1ccccc1

HCID67088392

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b5c3b2e5a26b4b8a915aeb3985f4219e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[NH:11][N:12]([CH3:13])[CH2:14][C:15](=[O:16])[OH:17].[NH2:18][CH:19]([C:20](=[O:21])[N:22]([CH2:23][c:24]1[cH:25][cH:26][cH:27][c:28]2[cH:29][cH:30][cH:31][n:32][c:33]12)[CH:34]([CH:35]([O:36][CH2:37][CH3:38])[O:39][CH2:40][CH3:41])[CH3:42])[CH2:43][C:44](=[O:45])[NH:46][C:47]([c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)([c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1)[c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[NH:11][N:12]([CH3:13])[CH2:14][C:15](=[O:17])[NH:18][CH:19]([C:20](=[O:21])[N:22]([CH2:23][c:24]1[cH:25][cH:26][cH:27][c:28]2[cH:29][cH:30][cH:31][n:32][c:33]12)[CH:34]([CH:35]([O:36][CH2:37][CH3:38])[O:39][CH2:40][CH3:41])[CH3:42])[CH2:43][C:44](=[O:45])[NH:46][C:47]([c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)([c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1)[c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1