Hydrochloric Acid → 2-[[5-[4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-2-pyridinyl]-1H-pyrrole-3-carbonyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid
Reaction equation
[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH3:53][OH:54].[ClH:57].[F:1][c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][c:8](-[c:12]3[cH:13][c:14]([C:17](=[O:18])[NH:19][CH:20]([C:21](=[O:22])[O:23][CH3:24])[CH2:25][CH2:26][C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[cH:15][nH:16]3)[n:9][cH:10][cH:11]2)[cH:34][cH:35][c:36]1[NH:37][C:38](=[O:39])[NH:40][c:41]1[cH:42][c:43]([CH3:47])[cH:44][cH:45][cH:46]1.[Na+:56].[OH-:55].[OH2:58]>>[F:1][c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][c:8](-[c:12]3[cH:13][c:14]([C:17](=[O:18])[NH:19][CH:20]([C:21](=[O:22])[OH:23])[CH2:25][CH2:26][C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[cH:15][nH:16]3)[n:9][cH:10][cH:11]2)[cH:34][cH:35][c:36]1[NH:37][C:38](=[O:39])[NH:40][c:41]1[cH:42][c:43]([CH3:47])[cH:44][cH:45][cH:46]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-66d018f2bd224ea89337e61820338985
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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