HRID935716

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID887

Methanol

CH4O

HCID961

Hydroxide

HO-

结构：COc1cc2nc(-c3ccc(-c4ccccc4)c(F)c3)nc(Nc3ccc4c(cnn4C(=O)OC(C)(C)C)c3)c2cc1OC(C)=O

HCID59361898

未命名化合物

PRODUCTS

生成物

结构：COc1cc2nc(-c3ccc(-c4ccccc4)c(F)c3)nc(Nc3ccc4c(cnn4C(=O)OC(C)(C)C)c3)c2cc1O

HCID59361974

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-46c7e7e7998544398e5f4e6dff52b37e
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1](=[O:2])([CH3:3])[O:4][c:5]1[cH:6][c:7]2[c:8]([NH:30][c:31]3[cH:32][c:33]4[cH:34][n:35][n:36]([C:40](=[O:41])[O:42][C:43]([CH3:44])([CH3:45])[CH3:46])[c:37]4[cH:38][cH:39]3)[n:9][c:10](-[c:17]3[cH:18][c:19]([F:29])[c:20](-[c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[cH:21][cH:22]3)[n:11][c:12]2[cH:13][c:14]1[O:15][CH3:16].[CH3:49][OH:50].[NH4+:48].[OH-:47]>>[OH:4][c:5]1[cH:6][c:7]2[c:8]([NH:30][c:31]3[cH:32][c:33]4[cH:34][n:35][n:36]([C:40](=[O:41])[O:42][C:43]([CH3:44])([CH3:45])[CH3:46])[c:37]4[cH:38][cH:39]3)[n:9][c:10](-[c:17]3[cH:18][c:19]([F:29])[c:20](-[c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[cH:21][cH:22]3)[n:11][c:12]2[cH:13][c:14]1[O:15][CH3:16]