Methanol → Cis-4-(5-{[2-({4-[(diethoxyphosphoryl)methyl]-2-methoxyphenyl}amino)-5-(trifluoromethyl)pyrimidin-4-yl]amino}-3-methyl-4-oxo-1,4-dihydroquinolin-8-yl)cyclohexanecarboxylic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][P:4](=[O:5])([O:6][CH2:7][CH3:8])[CH2:9][c:10]1[cH:11][c:12]([O:51][CH3:52])[c:13]([NH:16][c:17]2[n:18][cH:19][c:20]([C:47]([F:48])([F:49])[F:50])[c:21]([NH:23][c:24]3[c:25]4[c:26](=[O:46])[c:27]([CH3:45])[cH:28][nH:29][c:30]4[c:31]([CH:34]4[CH2:35][CH2:36][CH:37]([C:40](=[O:41])[O:42][CH2:43][CH3:44])[CH2:38][CH2:39]4)[cH:32][cH:33]3)[n:22]2)[cH:14][cH:15]1.[CH2:55]1[O:56][CH2:57][CH2:58][CH2:59]1.[CH3:60][OH:61].[Li+:53].[OH-:54].[OH2:62]>>[CH2:1]([CH3:2])[O:3][P:4](=[O:5])([O:6][CH2:7][CH3:8])[CH2:9][c:10]1[cH:11][c:12]([O:51][CH3:52])[c:13]([NH:16][c:17]2[n:18][cH:19][c:20]([C:47]([F:48])([F:49])[F:50])[c:21]([NH:23][c:24]3[c:25]4[c:26](=[O:46])[c:27]([CH3:45])[cH:28][nH:29][c:30]4[c:31]([CH:34]4[CH2:35][CH2:36][CH:37]([C:40](=[O:41])[OH:42])[CH2:38][CH2:39]4)[cH:32][cH:33]3)[n:22]2)[cH:14][cH:15]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-b88330b940e144d7b191d0acbc550bea
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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