HRID2329307

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID887

Methanol

CH4O

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

结构：CC(C)(C)OC(=O)NC(Cc1cn(CC=Cc2ccccc2)c2ccccc12)C(=O)OCc1ccccc1

HCID69414706

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC(Cc1cn(CC=Cc2ccccc2)c2ccccc12)C(=O)O

HCID69417030

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-929da1798bc04a9eab1bdb3eedca7e1d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([CH:10]([CH2:11][c:12]1[cH:13][n:14]([CH2:21][CH:22]=[CH:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12)[NH:30][C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])=[O:38].[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:46][OH:47].[K+:40].[OH-:39].[OH2:48]>>[O:8]=[C:9]([CH:10]([CH2:11][c:12]1[cH:13][n:14]([CH2:21][CH:22]=[CH:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12)[NH:30][C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[OH:38]