HRID2136800

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID6228

Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID167232

Periodate ion

IO4-

HCID12688643

未命名化合物

反应SMILES：COc1ccccc1NC(=O)CC(=O)Nc1ccc(Oc2ccnc3cc(-c4cccc(OCCCCl)c4)sc23)c(F)c1

HCID58790205

未命名化合物

PRODUCTS

产物

反应SMILES：CCS(=O)CCCOc1cccc(-c2cc3nccc(Oc4ccc(NC(=O)CC(=O)Nc5ccccc5OC)cc4F)c3s2)c1

HCID69498201

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-d74d3dae92a9421893089501de3dc71d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

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