HRID199809

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7914

Isopropyl ether

C6H14O

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID78288

Glycine, N-[(1,1-dimethylethoxy)carbonyl]-

C7H13NO4

HCID12409090

未命名化合物

PRODUCTS

生成物

结构：COc1cc(C)cc(OC)c1NC(=O)CNC(=O)OC(C)(C)C

HCID18936465

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3892e10608e14debb593f4d7997e0f7b
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

[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][CH2:9][C:10](=[O:11])[OH:12].[CH3:13][N:14]([CH3:15])[CH:16]=[O:17].[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[CH3:26][O:27][c:28]1[c:29]([NH2:30])[c:31]([O:36][CH3:37])[cH:32][c:33]([CH3:35])[cH:34]1.[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[CH:38]([O:39][CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[ClH:25]>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][CH2:9][C:10](=[O:12])[NH:30][c:29]1[c:28]([O:27][CH3:26])[cH:34][c:33]([CH3:35])[cH:32][c:31]1[O:36][CH3:37]