HRID282471

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID95657

N-(Benzyloxycarbonyl)-DL-alanine

C11H13NO4

结构：COc1cc2nccc(Oc3ccc(NC(=O)c4c(C)n(CC(C)O)n(-c5ccccc5)c4=O)cc3F)c2cc1OC

HCID59598352

未命名化合物

PRODUCTS

生成物

结构：COc1cc2nccc(Oc3ccc(NC(=O)c4c(C)n(CC(C)OC(=O)C(C)NC(=O)OCc5ccccc5)n(-c5ccccc5)c4=O)cc3F)c2cc1OC

HCID68740807

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-eb7ab395fa2246709621601641dbbede
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:43](=[O:44])([O:45][CH2:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1)[NH:53][CH:54]([CH3:55])[C:56](=[O:57])[OH:58].[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[c:17]([F:42])[cH:18][c:19]([NH:22][C:23](=[O:24])[c:25]4[c:26](=[O:41])[n:27](-[c:35]5[cH:36][cH:37][cH:38][cH:39][cH:40]5)[n:28]([CH2:31][CH:32]([CH3:33])[OH:34])[c:29]4[CH3:30])[cH:20][cH:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[c:17]([F:42])[cH:18][c:19]([NH:22][C:23](=[O:24])[c:25]4[c:26](=[O:41])[n:27](-[c:35]5[cH:36][cH:37][cH:38][cH:39][cH:40]5)[n:28]([CH2:31][CH:32]([CH3:33])[O:34][C:56]([CH:54]([NH:53][C:43](=[O:44])[O:45][CH2:46][c:47]5[cH:48][cH:49][cH:50][cH:51][cH:52]5)[CH3:55])=[O:57])[c:29]4[CH3:30])[cH:20][cH:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]