HRID1562125

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

结构：CCOC(=O)CN(C(=O)c1cccc(COc2ccc(-c3cc(F)c(F)cc3OC)cc2)c1)C(C)(C)C

HCID67152350

未命名化合物

PRODUCTS

生成物

结构：COc1cc(F)c(F)cc1-c1ccc(OCc2cccc(C(=O)N(CC(=O)O)C(C)(C)C)c2)cc1

HCID52933305

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7a0c86058c3b4e9abcb893a64c03954c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][N:6]([C:7]([CH3:8])([CH3:9])[CH3:10])[C:11]([c:12]1[cH:13][c:14]([CH2:18][O:19][c:20]2[cH:21][cH:22][c:23](-[c:26]3[c:27]([O:34][CH3:35])[cH:28][c:29]([F:33])[c:30]([F:32])[cH:31]3)[cH:24][cH:25]2)[cH:15][cH:16][cH:17]1)=[O:36])=[O:37].[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[Li+:39].[OH-:38].[OH2:45]>>[O:3]=[C:4]([CH2:5][N:6]([C:7]([CH3:8])([CH3:9])[CH3:10])[C:11]([c:12]1[cH:13][c:14]([CH2:18][O:19][c:20]2[cH:21][cH:22][c:23](-[c:26]3[c:27]([O:34][CH3:35])[cH:28][c:29]([F:33])[c:30]([F:32])[cH:31]3)[cH:24][cH:25]2)[cH:15][cH:16][cH:17]1)=[O:36])[OH:37]