HRID196119

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID8150

Diethylene glycol dimethyl ether

C6H14O3

HCID15852811

未命名化合物

HCID20310691

未命名化合物

PRODUCTS

生成物

HCID21409383

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-014d697d21174cd0883cf07e5bbc63c0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:39][C:40](=[O:41])[OH:42].[CH3:43][O:44][CH2:45][CH2:46][O:47][CH2:48][CH2:49][O:50][CH3:51].[CH3:52][OH:53].[NH:23]([CH:24]([NH:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[CH3:32])[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[O:1]=[c:2]1[c:3]2[c:4]([cH:5][cH:6][c:7]3[c:8]1[cH:9][cH:10][c:11]([CH:13]([C:14](=[O:15])[Cl:16])[CH3:17])[cH:12]3)[cH:18][cH:19][cH:20][cH:21]2.[OH2:22]>>[O:1]=[c:2]1[c:3]2[c:4]([cH:5][cH:6][c:7]3[c:8]1[cH:9][cH:10][c:11]([CH:13]([CH:14]=[O:15])[CH3:17])[cH:12]3)[cH:18][cH:19][cH:20][cH:21]2