HRID939318

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID19660

Carbonate

CO3-2

HCID4233041

3-Boc-aminopiperidine

C10H20N2O2

结构：CC(C)=CCn1c(Cl)nc2c1c(=O)n(CC(=O)c1ccccc1O)c(=O)n2C

HCID57514534

未命名化合物

PRODUCTS

生成物

结构：CC(C)=CCn1c(N2CCCC(NC(=O)OC(C)(C)C)C2)nc2c1c(=O)n(CC(=O)c1ccccc1O)c(=O)n2C

HCID66723736

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-98665aeb8b044fcca35c6ca23fd9612a
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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