HRID104887

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID962

Water

H2O

HCID6228

Dimethylformamide

C3H7NO

HCID19660

Carbonate Ion

CO3-2

HCID30165

Iodide ion

I-

HCID66052

tert-Butyl chloroacetate

C6H11ClO2

HCID178471333

未命名化合物

PRODUCTS

产物

HCID76116357

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-34a1a8b6f8af4609995b442598ed2b48
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[C:51](=[O:52])([O-:53])[O-:54].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]1[CH2:12][CH2:13][CH:14]([CH2:17][CH2:18][CH2:19][CH2:20][CH:21]([C:22](=[O:23])[O:24][CH2:25][CH3:26])[NH:27][CH:28]2[CH2:29][S:30][c:31]3[c:32]([cH:36][cH:37][cH:38][cH:39]3)[NH:33][C:34]2=[O:35])[CH2:15][CH2:16]1.[CH3:58][N:59]([CH3:60])[CH:61]=[O:62].[Cl:40][CH2:41][C:42](=[O:43])[O:44][C:45]([CH3:46])([CH3:47])[CH3:48].[I-:50].[K+:49].[K+:55].[K+:56].[OH2:57]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]1[CH2:12][CH2:13][CH:14]([CH2:17][CH2:18][CH2:19][CH2:20][CH:21]([C:22](=[O:23])[O:24][CH2:25][CH3:26])[NH:27][CH:28]2[CH2:29][S:30][c:31]3[c:32]([cH:36][cH:37][cH:38][cH:39]3)[N:33]([CH2:41][C:42](=[O:43])[O:44][C:45]([CH3:46])([CH3:47])[CH3:48])[C:34]2=[O:35])[CH2:15][CH2:16]1