Ethanol → 3-[2-Ethyl-5-(1,3,3-trimethyl-6-aza-bicyclo[3.2.1]octane-6-carbonyl)-benzimidazol-1-yl]-propionic Acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][n:7]1[c:8]([CH2:29][CH3:30])[n:9][c:10]2[c:11]1[cH:12][cH:13][c:14]([C:16](=[O:17])[N:18]1[CH:19]3[CH2:20][C:21]([CH3:27])([CH3:28])[CH2:22][C:23]([CH3:26])([CH2:24]1)[CH2:25]3)[cH:15]2)=[O:31].[CH3:34][CH2:35][OH:36].[Na+:33].[OH-:32]>>[O:3]=[C:4]([CH2:5][CH2:6][n:7]1[c:8]([CH2:29][CH3:30])[n:9][c:10]2[c:11]1[cH:12][cH:13][c:14]([C:16](=[O:17])[N:18]1[CH:19]3[CH2:20][C:21]([CH3:27])([CH3:28])[CH2:22][C:23]([CH3:26])([CH2:24]1)[CH2:25]3)[cH:15]2)[OH:31]Participants
5
Sources & evidence
- ORD record
- ord-25c929cb02ff4a29a65c0eb92f365b42
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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