HRID149179

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID11776

Triphenylphosphine

C18H15P

HCID220568

Diethyl azodicarboxylate

C6H10N2O4

HCID22504306

未命名化合物

结构：COC(=O)Oc1cc(Nc2ncnc3cc(O)c(OC)cc23)c(F)cc1C

HCID135549390

未命名化合物

PRODUCTS

生成物

结构：COC(=O)Oc1cc(Nc2ncnc3cc(OCc4cc(C)nc(Cl)c4)c(OC)cc23)c(F)cc1C

HCID22624994

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3c76f1f4555f477abccfc913f8d0f11e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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