Citric Acid → 3-(4-{Acetyl[(2',6'-dimethylbiphenyl-3-yl)methyl]amino}phenyl)propanoic acid
Reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]([c:5]1[cH:6][cH:7][c:8]([CH2:11][CH2:12][C:13](=[O:14])[O:15][CH3:16])[cH:9][cH:10]1)[CH2:17][c:18]1[cH:19][c:20](-[c:24]2[c:25]([CH3:31])[cH:26][cH:27][cH:28][c:29]2[CH3:30])[cH:21][cH:22][cH:23]1.[CH3:48][OH:49].[Na+:33].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[OH-:32].[OH2:34].[OH:35][C:36]([CH2:37][C:38]([C:39](=[O:40])[OH:41])([CH2:42][C:43](=[O:44])[OH:45])[OH:46])=[O:47]>>[C:1]([CH3:2])(=[O:3])[N:4]([c:5]1[cH:6][cH:7][c:8]([CH2:11][CH2:12][C:13](=[O:14])[OH:15])[cH:9][cH:10]1)[CH2:17][c:18]1[cH:19][c:20](-[c:24]2[c:25]([CH3:31])[cH:26][cH:27][cH:28][c:29]2[CH3:30])[cH:21][cH:22][cH:23]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-234ff6372228401cb698f7efb931273c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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