HRID1125924

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID28123

Tetrahydroborate

H4B-

结构：CCOP(C)(=O)CCC(=O)c1ccc(C(=O)Nc2cc(-c3cccs3)ccc2NC(=O)OC(C)(C)C)cc1

HCID57925974

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc(C2CCP(C)(=O)O2)cc1

HCID57926008

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-404069c523644f0e87efb505e7e66212
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

[BH4-:39].[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[CH3:1][C:2]([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[c:10]([NH:20][C:21](=[O:22])[c:23]2[cH:24][cH:25][c:26]([C:29]([CH2:30][CH2:31][P:32]([O:33][CH2:35][CH3:38])(=[O:36])[CH3:37])=[O:34])[cH:27][cH:28]2)[cH:11][c:12](-[c:15]2[s:16][cH:17][cH:18][cH:19]2)[cH:13][cH:14]1.[Cl-:41].[NH4+:42].[Na+:40]>>[CH3:1][C:2]([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[c:10]([NH:20][C:21](=[O:22])[c:23]2[cH:24][cH:25][c:26]([CH:29]3[CH2:30][CH2:31][P:32](=[O:36])([CH3:37])[O:33]3)[cH:27][cH:28]2)[cH:11][c:12](-[c:15]2[s:16][cH:17][cH:18][cH:19]2)[cH:13][cH:14]1