HRID673299

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

反应SMILES：COC(=O)COc1ccc(N(C(C)=O)C2CC(C)N(C(=O)c3ccc(OC)cc3)c3ccccc32)cc1

HCID68921236

未命名化合物

PRODUCTS

产物

反应SMILES：COc1ccc(C(=O)N2c3ccccc3C(N(C(C)=O)c3ccc(OCC(=O)O)cc3)CC2C)cc1

HCID21092876

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-429b1e3d72fd4a63a78c56189400d7ba
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

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