HRID2125649

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID28123

Tetrahydroborate

H4B-

反应SMILES：CCCc1c(Cc2ccc(-c3ccccc3C#N)cc2)c(=O)n(CC(=O)C(C)(C)C)c2nc(C)nn12

HCID67008981

未命名化合物

PRODUCTS

产物

HCID67009299

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-f7cfa8071a8f4fc2aa60d03a1c01d3de
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

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