Ethanol → 3-{[(4-{[Cyclopentyl(3-methyl-1-benzothiophen-2-yl)methyl]amino}phenyl)carbonyl](methyl)amino}propanoic acid
Reaction equation
[CH2:35]([OH:36])[CH3:37].[CH3:38][CH2:39][CH2:40][CH2:41][CH2:42][CH3:43].[CH3:44][CH2:45][OH:46].[CH:1]1([CH:6]([c:7]2[s:8][c:9]3[c:10]([c:11]2[CH3:12])[cH:13][cH:14][cH:15][cH:16]3)[NH:17][c:18]2[cH:19][cH:20][c:21]([C:24](=[O:25])[N:26]([CH2:27][CH2:28][C:29](=[O:30])[O:31][CH2:32][CH3:33])[CH3:34])[cH:22][cH:23]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[Na+:48].[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1.[OH-:47]>>[CH:1]1([CH:6]([c:7]2[s:8][c:9]3[c:10]([c:11]2[CH3:12])[cH:13][cH:14][cH:15][cH:16]3)[NH:17][c:18]2[cH:19][cH:20][c:21]([C:24](=[O:25])[N:26]([CH2:27][CH2:28][C:29](=[O:30])[OH:31])[CH3:34])[cH:22][cH:23]2)[CH2:2][CH2:3][CH2:4][CH2:5]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-bb71a0b186414418b3cd503c0986528f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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