HRID1143619

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID178418361

未命名化合物

结构：CC(=O)N1CCN(C(=O)OC(C)(C)C)C(C(O)C(Cc2ccccc2)N=C(c2ccccc2)c2ccccc2)C1

HCID178473920

未命名化合物

PRODUCTS

生成物

结构：CC(=O)N1CCN(C(=O)OC(C)(C)C)C(C(O)C(N)Cc2ccccc2)C1

HCID69015142

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5c7551f3054444ec9e0f41f54661ddba
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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