HRID141455

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID15723

Azacyclonol

C18H21NO

结构：CN(CC(CCS(C)(=O)=O)c1ccccc1)C(=O)c1ccccc1

HCID18354437

未命名化合物

PRODUCTS

生成物

结构：CN(CC(CCN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1)c1ccccc1)C(=O)c1ccccc1

HCID15870532

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9ff319b80f024977b0263742060f9e09
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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