Citric Acid → 3-(2-fluoro-4-{[4-({5-(2-phenylethyl)-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-1-yl}methyl)benzyl]amino}phenyl)propanoic acid
Reaction equation
[CH3:63][CH2:64][OH:65].[F:1][c:2]1[c:3]([CH2:40][CH2:41][C:42](=[O:43])[O:44][CH2:45][CH3:46])[cH:4][cH:5][c:6]([NH:8][CH2:9][c:10]2[cH:11][cH:12][c:13]([CH2:16][n:17]3[n:18][c:19](-[c:30]4[cH:31][cH:32][c:33]([C:36]([F:37])([F:38])[F:39])[cH:34][cH:35]4)[cH:20][c:21]3[CH2:22][CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:14][cH:15]2)[cH:7]1.[Na+:48].[O:66]1[CH2:67][CH2:68][CH2:69][CH2:70]1.[OH-:47].[OH2:49].[OH:50][C:51]([CH2:52][C:53]([C:54](=[O:55])[OH:56])([CH2:57][C:58](=[O:59])[OH:60])[OH:61])=[O:62]>>[F:1][c:2]1[c:3]([CH2:40][CH2:41][C:42](=[O:43])[OH:44])[cH:4][cH:5][c:6]([NH:8][CH2:9][c:10]2[cH:11][cH:12][c:13]([CH2:16][n:17]3[n:18][c:19](-[c:30]4[cH:31][cH:32][c:33]([C:36]([F:37])([F:38])[F:39])[cH:34][cH:35]4)[cH:20][c:21]3[CH2:22][CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:14][cH:15]2)[cH:7]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-722a5b281aaa4db5adde279556640e5c
- Source dataset
- Validation data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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