HRID2337367

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID6973

5-Methylsalicylic acid

C8H8O3

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID20115564

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(cc1OC)CN(CCCCNC(=O)c1cc(C)ccc1O)CC2

HCID16738306

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d81f82c4b07845f08ce06824c0bff50c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH3:12][O:13][c:14]1[cH:15][c:16]2[c:21]([cH:22][c:23]1[O:24][CH3:25])[CH2:20][N:19]([CH2:26][CH2:27][CH2:28][CH2:29][NH2:30])[CH2:18][CH2:17]2.[CH3:1][c:2]1[cH:3][cH:4][c:5]([OH:11])[c:6]([C:7](=[O:8])[OH:9])[cH:10]1.[CH:31]1([N:32]=[C:33]=[N:34][CH:35]2[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]2)[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45]1.[Cl:57][CH2:58][Cl:59].[OH2:46].[OH:47][n:48]1[c:49]2[cH:50][cH:51][cH:52][cH:53][c:54]2[n:55][n:56]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([OH:11])[c:6]([C:7](=[O:9])[NH:30][CH2:29][CH2:28][CH2:27][CH2:26][N:19]2[CH2:18][CH2:17][c:16]3[cH:15][c:14]([O:13][CH3:12])[c:23]([O:24][CH3:25])[cH:22][c:21]3[CH2:20]2)[cH:10]1