HRID674573

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID962

Water

H2O

HCID77039

N-Methylhomoveratrylamine

C11H17NO2

HCID22758376

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：COc1ccc(CCN(C)CCCC2(c3ccc(OC)c(OC)c3)S(=O)CCCS2=O)cc1OC

HCID86734432

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7ccb931e68154221b8000516a4c9e4af
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

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