Hydroxide → 1-[1-[3-[4-amino-3-chloro-5-(trifluoromethyl)phenyl]-2-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidine-1-carbonyl]oxypropanoyl]piperidin-4-yl]-4-methylpiperazine-2-carboxylic acid
Reaction equation
[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[Li+:2].[NH2:3][c:4]1[c:5]([Cl:57])[cH:6][c:7]([CH2:14][CH:15]([C:16](=[O:17])[N:18]2[CH2:19][CH2:20][CH:21]([N:24]3[CH:25]([C:31](=[O:32])[O:33][CH2:34][CH3:35])[CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]3)[CH2:22][CH2:23]2)[O:36][C:37](=[O:38])[N:39]2[CH2:40][CH2:41][CH:42]([N:45]3[C:46](=[O:56])[NH:47][c:48]4[c:49]([cH:52][cH:53][cH:54][cH:55]4)[CH2:50][CH2:51]3)[CH2:43][CH2:44]2)[cH:8][c:9]1[C:10]([F:11])([F:12])[F:13].[OH-:1]>>[NH2:3][c:4]1[c:5]([Cl:57])[cH:6][c:7]([CH2:14][CH:15]([C:16](=[O:17])[N:18]2[CH2:19][CH2:20][CH:21]([N:24]3[CH:25]([C:31](=[O:32])[OH:33])[CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]3)[CH2:22][CH2:23]2)[O:36][C:37](=[O:38])[N:39]2[CH2:40][CH2:41][CH:42]([N:45]3[C:46](=[O:56])[NH:47][c:48]4[c:49]([cH:52][cH:53][cH:54][cH:55]4)[CH2:50][CH2:51]3)[CH2:43][CH2:44]2)[cH:8][c:9]1[C:10]([F:11])([F:12])[F:13]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-11273ab6e367471b868225d62844fbe7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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