HRID693237

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID260

Hydrogen Bromide

BrH

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID77070

Veratroyl chloride

C9H9ClO3

HCID13646030

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(=O)N2CCN(c3ccc4c(c3)CC(=O)N4)CC2)cc1OC

HCID13646032

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-30a003a60b8a47cdb81590ec6b960df5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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