Potassium Cation → 3-[3-Butoxy-4-[3-[heptylcarbamoyl(methyl)amino]phenyl]phenyl]-2-ethoxyprop-2-enoic acid
Reaction equation
[C:42](=[O:43])([O-:44])[O-:45].[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[cH:7][c:8]([CH:13]=[C:14]([C:15](=[O:16])[OH:17])[O:18][CH2:19][CH3:20])[cH:9][cH:10][c:11]1[I:12].[CH2:21]([CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH3:27])[NH:28][C:29]([N:30]([CH3:31])[c:32]1[cH:33][c:34]([B:38]([OH:39])[OH:40])[cH:35][cH:36][cH:37]1)=[O:41].[CH3:50][O:51][CH2:52][CH2:53][O:54][CH3:55].[K+:46].[K+:47].[OH2:48].[OH2:49]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[cH:7][c:8]([CH:13]=[C:14]([C:15](=[O:16])[OH:17])[O:18][CH2:19][CH3:20])[cH:9][cH:10][c:11]1-[c:34]1[cH:33][c:32]([N:30]([C:29]([NH:28][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH3:27])=[O:41])[CH3:31])[cH:37][cH:36][cH:35]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-dfcd592c48324b45a524827863016358
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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