HRID136522

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID7971

3-Pyridinol

C5H5NO

HCID8028

Tetrahydrofuran

C4H8O

HCID47263

Cetaben

C23H39NO2

HCID68263

1,1'-Carbonylbis(1H-imidazole)

C7H6N4O

HCID166653

Hydride

H-

PRODUCTS

生成物

结构：CCCCCCCCCCCCCCCCNc1ccc(C(=O)Oc2cccnc2)cc1

HCID23457762

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-866b976e923f44a196b59c5bc8ca1e2c
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

[C:27]([n:28]1[cH:29][cH:30][n:31][cH:32]1)([n:33]1[cH:34][cH:35][n:36][cH:37]1)=[O:38].[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])[NH:17][c:18]1[cH:19][cH:20][c:21]([C:22](=[O:23])[OH:24])[cH:25][cH:26]1.[H-:46].[Na+:47].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[OH:39][c:40]1[cH:41][n:42][cH:43][cH:44][cH:45]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])[NH:17][c:18]1[cH:19][cH:20][c:21]([C:22](=[O:23])[O:24][c:40]2[cH:41][n:42][cH:43][cH:44][cH:45]2)[cH:25][cH:26]1