Methanesulfonic Acid → 2-{[6-(4-Acetylphenyl)hexyl]oxy}-5-[3-(ethoxycarbonyl)benzoyl]benzenepropanoic acid ethyl ester
Reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][OH:16])[cH:8][cH:9]1.[CH2:22]([CH3:23])[O:24][C:25]([CH2:26][CH2:27][c:28]1[c:29]([OH:47])[cH:30][cH:31][c:32]([C:34]([c:35]2[cH:36][c:37]([C:41](=[O:42])[O:43][CH2:44][CH3:45])[cH:38][cH:39][cH:40]2)=[O:46])[cH:33]1)=[O:48].[CH3:17][S:18]([OH:19])(=[O:20])=[O:21]>>[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][O:16][c:29]2[c:28]([CH2:27][CH2:26][C:25]([O:24][CH2:22][CH3:23])=[O:48])[cH:33][c:32]([C:34]([c:35]3[cH:36][c:37]([C:41](=[O:42])[O:43][CH2:44][CH3:45])[cH:38][cH:39][cH:40]3)=[O:46])[cH:31][cH:30]2)[cH:8][cH:9]1Participants
4
Sources & evidence
- ORD record
- ord-1f8bdad9398445f08cd9b6914abe3a37
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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