HRID301011

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID76360

4-(Hydroxymethyl)benzoic acid

C8H8O3

HCID15176238

未命名化合物

PRODUCTS

生成物

结构：O=C(NC1(C(=O)OCc2ccccc2)CCCCC1)c1ccc(CO)cc1

HCID57672813

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5daa77ab41a1414d980841c45e68967b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:2]([N:3]=[C:4]=[N:5][CH2:6][CH2:7][CH2:8][N:9]([CH3:10])[CH3:11])[CH3:12].[CH2:51]([Cl:52])[Cl:53].[ClH:1].[OH:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([C:19](=[O:20])[OH:21])[cH:22][cH:23]1.[OH:41][n:42]1[c:43]2[cH:44][cH:45][cH:46][cH:47][c:48]2[n:49][n:50]1.[c:24]1([CH2:30][O:31][C:32](=[O:33])[C:34]2([NH2:40])[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]2)[cH:25][cH:26][cH:27][cH:28][cH:29]1>>[OH:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([C:19](=[O:21])[NH:40][C:34]2([C:32]([O:31][CH2:30][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)=[O:33])[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]2)[cH:22][cH:23]1