HRID1571568

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID75452

4-Methoxybenzylamine

C8H11NO

HCID76257

Diethylphosphorocyanidate

C5H10NO3P

结构：COc1cc2c(CC(=O)O)cnc(CNC(=O)OC(C)(C)C)c2cc1OC

HCID68613423

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(CNC(=O)Cc2cnc(CNC(=O)OC(C)(C)C)c3cc(OC)c(OC)cc23)cc1

HCID59341099

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3ddab94e05e9437f972afbe8d30f0bf7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][c:10]1[n:11][cH:12][c:13]([CH2:24][C:25](=[O:26])[OH:27])[c:14]2[cH:15][c:16]([O:22][CH3:23])[c:17]([O:20][CH3:21])[cH:18][c:19]12.[C:38]([P:39](=[O:40])([O:41][CH2:42][CH3:43])[O:44][CH2:45][CH3:46])#[N:47].[CH3:28][O:29][c:30]1[cH:31][cH:32][c:33]([CH2:34][NH2:35])[cH:36][cH:37]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][c:10]1[n:11][cH:12][c:13]([CH2:24][C:25](=[O:26])[NH:35][CH2:34][c:33]2[cH:32][cH:31][c:30]([O:29][CH3:28])[cH:37][cH:36]2)[c:14]2[cH:15][c:16]([O:22][CH3:23])[c:17]([O:20][CH3:21])[cH:18][c:19]12