HRID2329282

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID62406

未命名化合物

HCID66612094

未命名化合物

PRODUCTS

产物

HCID66611700

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-c5906819dfbf4c0bb788b3f2cabec799
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

[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][c:6]([NH:12][c:13]2[n:14][cH:15][c:16]([CH:45]([CH3:46])[N:47]3[CH2:48][CH2:49][N:50]([S:53](=[O:54])(=[O:55])[CH3:56])[CH2:51][CH2:52]3)[cH:17][c:18]2-[c:19]2[n:20][c:21]([N:26]([CH2:27][c:28]3[cH:29][cH:30][c:31]([O:32][CH3:33])[cH:34][cH:35]3)[CH2:36][c:37]3[cH:38][cH:39][c:40]([O:41][CH3:42])[cH:43][cH:44]3)[n:22][c:23]([CH3:25])[n:24]2)[cH:7][n:8][c:9]1[O:10][CH3:11].[F:65][C:66]([F:67])([F:68])[C:69]([OH:70])=[O:71].[OH:57][S:58]([C:59]([F:60])([F:61])[F:62])(=[O:63])=[O:64]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][c:6]([NH:12][c:13]2[n:14][cH:15][c:16]([CH:45]([CH3:46])[N:47]3[CH2:48][CH2:49][N:50]([S:53](=[O:54])(=[O:55])[CH3:56])[CH2:51][CH2:52]3)[cH:17][c:18]2-[c:19]2[n:20][c:21]([NH2:26])[n:22][c:23]([CH3:25])[n:24]2)[cH:7][n:8][c:9]1[O:10][CH3:11]