Acetic Acid → HCID 58739268, compound
Reaction equation
[C:36]([BH3-:37])#[N:38].[CH3:32][C:33]([CH3:34])=[O:35].[CH3:40][C:41](=[O:42])[OH:43].[CH:1]1([CH2:4][n:5]2[c:6](=[O:31])[n:7]([CH2:23][c:24]3[c:25]([F:30])[cH:26][cH:27][cH:28][cH:29]3)[c:8](=[O:22])[c:9]3[nH:10][c:11]([CH2:14][c:15]4[cH:16][cH:17][c:18]([NH2:21])[cH:19][cH:20]4)[n:12][c:13]23)[CH2:2][CH2:3]1.[Cl:49][CH2:50][Cl:51].[Na+:39].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1>>[CH:1]1([CH2:4][n:5]2[c:6](=[O:31])[n:7]([CH2:23][c:24]3[c:25]([F:30])[cH:26][cH:27][cH:28][cH:29]3)[c:8](=[O:22])[c:9]3[nH:10][c:11]([CH2:14][c:15]4[cH:16][cH:17][c:18]([NH:21][CH:33]([CH3:32])[CH3:34])[cH:19][cH:20]4)[n:12][c:13]23)[CH2:2][CH2:3]1Participants
8
Sources & evidence
- ORD record
- ord-d5e474441da54cf7bd1660a74c3338aa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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