HRID136718

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID3348

Fexofenadine

C32H39NO4

HCID8078

Cyclohexane

C6H12

PRODUCTS

产物

HCID3348

Fexofenadine

C32H39NO4

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-3e80434f984749b7b8d322acca1dfa52
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

[CH2:39]1[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44]1.[CH3:1][C:2]([CH3:3])([C:4]([OH:5])=[O:6])[c:7]1[cH:8][cH:9][c:10]([CH:13]([OH:14])[CH2:15][CH2:16][CH2:17][N:18]2[CH2:19][CH2:20][CH:21]([C:24]([OH:25])([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[CH2:22][CH2:23]2)[cH:11][cH:12]1.[ClH:38]>>[CH3:1][C:2]([CH3:3])([C:4](=[O:5])[OH:6])[c:7]1[cH:8][cH:9][c:10]([CH:13]([OH:14])[CH2:15][CH2:16][CH2:17][N:18]2[CH2:19][CH2:20][CH:21]([C:24]([OH:25])([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[CH2:22][CH2:23]2)[cH:11][cH:12]1