HRID94661

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

结构：CCOC(=O)C=Cc1cn(-c2ccc(C(C)C)cc2)c2cnc(-c3c(CC)cccc3CC)cc12

HCID67152411

未命名化合物

PRODUCTS

生成物

HCID67152479

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3bb18e41e48c450aaf36c9226bd795c2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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