Citric Acid → 3-{4-[3-(5,5-Dimethyl-3-trifluoromethyl-4,5,6,7-tetrahydro-benzo[c]thiophen-1-yl)-3-oxo-propyl]-2-ethyl-6-methyl-phenyl}-propionic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][c:7]1[c:8]([CH2:33][CH3:34])[cH:9][c:10]([CH2:14][CH2:15][C:16](=[O:17])[c:18]2[s:19][c:20]([C:29]([F:30])([F:31])[F:32])[c:21]3[c:22]2[CH2:23][CH2:24][C:25]([CH3:27])([CH3:28])[CH2:26]3)[cH:11][c:12]1[CH3:13])=[O:35].[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH3:41][OH:42].[Li+:44].[OH-:43].[OH:45][C:46]([CH2:47][C:48]([C:49](=[O:50])[OH:51])([CH2:52][C:53](=[O:54])[OH:55])[OH:56])=[O:57]>>[O:3]=[C:4]([CH2:5][CH2:6][c:7]1[c:8]([CH2:33][CH3:34])[cH:9][c:10]([CH2:14][CH2:15][C:16](=[O:17])[c:18]2[s:19][c:20]([C:29]([F:30])([F:31])[F:32])[c:21]3[c:22]2[CH2:23][CH2:24][C:25]([CH3:27])([CH3:28])[CH2:26]3)[cH:11][c:12]1[CH3:13])[OH:35]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-ee2daf9a3bb44943b5e4cbb8f8e0cfb3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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