Acetic Acid → HCID 10268713, compound
Reaction equation
[C:28]([BH3-:29])#[N:30].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][S:6][c:7]1[n:8][cH:9][c:10]([CH2:14][c:15]2[s:16][cH:17][cH:18][cH:19]2)[c:11]([NH2:13])[n:12]1)=[O:20].[CH3:24][C:25](=[O:26])[OH:27].[CH3:44][C:45]#[N:46].[CH:21]([CH3:22])=[O:23].[F:37][C:38]([F:39])([F:40])[C:41]([OH:42])=[O:43].[Na+:31].[O:32]=[CH:33][N:34]([CH3:35])[CH3:36]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][S:6][c:7]1[n:8][cH:9][c:10]([CH2:14][c:15]2[s:16][cH:17][cH:18][cH:19]2)[c:11]([NH:13][CH2:21][CH3:22])[n:12]1)=[O:20]Participants
9
Sources & evidence
- ORD record
- ord-0c352d01d86844748b99cbdf69d35fe3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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