HRID171374

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID8857

Ethyl acetate

C4H8O2

HCID28123

Tetrahydroborate

H4B-

结构：CC1(C)OCC(Cc2ccccc2)N1C(=O)C(=O)c1ccn(-c2ccc(-c3ccccc3)cc2)c1

HCID18380312

未命名化合物

PRODUCTS

生成物

HCID18380297

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-32a86cedc7794ce594a02dbc167a966d
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

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