HRID1143426

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID59553142

未命名化合物

HCID59553311

未命名化合物

PRODUCTS

生成物

结构：COC(=O)COc1ccc(NC(=O)c2cc(F)cc(N3CCC(C)CC3)c2)c2ccccc12

HCID59553324

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3c93b9a6f7c347b594038e86cc495e95
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

[CH3:51][O:52][C:53]([CH2:54][O:55][c:56]1[cH:57][cH:58][c:59]([NH2:66])[c:60]2[cH:61][cH:62][cH:63][cH:64][c:65]12)=[O:67].[CH3:68][N:69]([CH3:70])[CH:71]=[O:72].[CH:42]([N:43]([CH:44]([CH3:45])[CH3:46])[CH2:47][CH3:48])([CH3:49])[CH3:50].[F:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[OH:7])[cH:8][c:9]([N:11]2[CH2:12][CH2:13][CH:14]([CH3:17])[CH2:15][CH2:16]2)[cH:10]1.[OH2:73].[P-:18]([F:19])([F:20])([F:21])([F:22])([F:23])[F:24].[n:25]1([O:26][C:27]([N:28]([CH3:29])[CH3:30])=[N+:31]([CH3:32])[CH3:33])[c:34]2[cH:35][cH:36][cH:37][cH:38][c:39]2[n:40][n:41]1>>[F:1][c:2]1[cH:3][c:4]([C:5](=[O:7])[NH:66][c:59]2[cH:58][cH:57][c:56]([O:55][CH2:54][C:53]([O:52][CH3:51])=[O:67])[c:65]3[c:60]2[cH:61][cH:62][cH:63][cH:64]3)[cH:8][c:9]([N:11]2[CH2:12][CH2:13][CH:14]([CH3:17])[CH2:15][CH2:16]2)[cH:10]1