HRID86582

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8058

Hexane

C6H14

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl Acetate

C4H8O2

HCID62324

Propanoyl chloride

C3H5ClO

HCID70048

Norcyclizine

C17H20N2

HCID53824140

未命名化合物

PRODUCTS

产物

HCID53821346

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-897549896a82441d9ad23b93da04936e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[C:60]([O:61][CH2:62][CH3:63])(=[O:64])[CH3:65].[CH2:27]([C:28]([Cl:29])=[O:30])[CH3:31].[CH3:1][O:2][c:3]1[c:4]([CH:13]=[CH:14][CH:15]=[CH:16][C:17](=[O:18])[OH:19])[cH:5][cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10].[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH3:54][CH2:55][CH2:56][CH2:57][CH2:58][CH3:59].[CH:32]([c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)([c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[N:45]1[CH2:46][CH2:47][NH:48][CH2:49][CH2:50]1.[Cl:51][CH2:52][Cl:53].[OH2:66]>>[CH3:1][O:2][c:3]1[c:4]([CH:13]=[CH:14][CH:15]=[CH:16][C:17](=[O:19])[N:48]2[CH2:47][CH2:46][N:45]([CH:32]([c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[CH2:50][CH2:49]2)[cH:5][cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10]