HRID154676

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID75799

Benzo-1,3-dioxole-5-methylamine

C8H9NO2

HCID54567981

未命名化合物

PRODUCTS

生成物

结构：CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCNCc1ccc2c(c1)OCO2

HCID53950388

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c71c783b4f084d38a8b6f74086373a87
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

[CH2:1]([CH:2]=[C:3]([CH3:4])[CH2:5][CH2:6][CH:7]=[C:8]([CH3:9])[CH3:10])[CH2:11][C:12](=[CH:13][CH2:14][CH2:15][C:16](=[CH:17][CH2:18][Br:19])[CH3:20])[CH3:21].[CH2:22]([c:23]1[cH:24][c:25]2[c:29]([cH:30][cH:31]1)[O:28][CH2:27][O:26]2)[NH2:32].[CH2:34]1[O:35][CH2:36][CH2:37][CH2:38]1.[OH2:33]>>[CH2:1]([CH:2]=[C:3]([CH3:4])[CH2:5][CH2:6][CH:7]=[C:8]([CH3:9])[CH3:10])[CH2:11][C:12](=[CH:13][CH2:14][CH2:15][C:16](=[CH:17][CH2:18][NH:32][CH2:22][c:23]1[cH:24][c:25]2[c:29]([cH:30][cH:31]1)[O:28][CH2:27][O:26]2)[CH3:20])[CH3:21]