HRID2157589

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID19957700

未命名化合物

HCID19957708

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(C(C)C)c(OCCN(C)Cc2c(C)c(O)c(C)c(C)c2OCCO)c1

HCID19957701

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6bf697b1d53d4ab8af0c1c8c5536c7ca
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

[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:24][NH:25][CH2:26][CH2:27][O:28][c:29]1[c:30]([CH:36]([CH3:37])[CH3:38])[cH:31][cH:32][c:33]([CH3:35])[cH:34]1.[CH3:40][N:41]([CH3:42])[CH:43]=[O:44].[OH2:39].[OH:8][c:9]1[c:10]([CH3:23])[c:11]([CH2:12][Cl:13])[c:14]([O:19][CH2:20][CH2:21][OH:22])[c:15]([CH3:18])[c:16]1[CH3:17]>>[OH:8][c:9]1[c:10]([CH3:23])[c:11]([CH2:12][N:25]([CH3:24])[CH2:26][CH2:27][O:28][c:29]2[c:30]([CH:36]([CH3:37])[CH3:38])[cH:31][cH:32][c:33]([CH3:35])[cH:34]2)[c:14]([O:19][CH2:20][CH2:21][OH:22])[c:15]([CH3:18])[c:16]1[CH3:17]