HRID1115188

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8857

Ethyl Acetate

C4H8O2

HCID31275

1,4-Dioxane

C4H8O2

2 次

HCID58337196

未命名化合物

PRODUCTS

产物

HCID58337221

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-0e6a404f71f144d18cff8873d8fb8882
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

[CH2:61]1[O:62][CH2:63][CH2:64][O:65][CH2:66]1.[CH3:1][O:2][c:3]1[c:4](-[c:13]2[cH:14][cH:15][c:16]3[c:21]([c:22]2[CH2:23][N:24]([C:25](=[O:26])[O:27][CH2:28][CH:29]2[c:30]4[cH:31][cH:32][cH:33][cH:34][c:35]4-[c:36]4[cH:37][cH:38][cH:39][cH:40][c:41]42)[c:42]2[c:43]([O:48][CH3:49])[cH:44][cH:45][cH:46][cH:47]2)[N:20]([CH3:50])[C:19](=[O:51])[C:18]([CH3:52])([CH3:53])[NH:17]3)[cH:5][cH:6][c:7]([O:9][CH2:10][O:11][CH3:12])[cH:8]1.[CH3:67][CH2:68][O:69][C:70](=[O:71])[CH3:72].[ClH:60].[O:54]1[CH2:55][CH2:56][O:57][CH2:58][CH2:59]1>>[CH3:1][O:2][c:3]1[c:4](-[c:13]2[cH:14][cH:15][c:16]3[c:21]([c:22]2[CH2:23][N:24]([C:25](=[O:26])[O:27][CH2:28][CH:29]2[c:30]4[cH:31][cH:32][cH:33][cH:34][c:35]4-[c:36]4[cH:37][cH:38][cH:39][cH:40][c:41]42)[c:42]2[c:43]([O:48][CH3:49])[cH:44][cH:45][cH:46][cH:47]2)[N:20]([CH3:50])[C:19](=[O:51])[C:18]([CH3:52])([CH3:53])[NH:17]3)[cH:5][cH:6][c:7]([OH:9])[cH:8]1