Acetic Acid → HCID 69047808, compound
Reaction equation
[C:33]([O:34][BH-:35]([O:36][C:37](=[O:38])[CH3:39])[O:40][C:41](=[O:42])[CH3:43])(=[O:44])[CH3:45].[C:49](=[O:50])([OH:51])[O-:52].[CH3:23][CH:24]([CH2:25][O:26][CH3:27])[NH2:28].[CH3:29][C:30](=[O:31])[OH:32].[CH3:47][OH:48].[Na+:46].[Na+:53].[O:1]=[CH:2][CH2:3][CH2:4][c:5]1[n:6][c:7]([C:21]#[N:22])[n:8][c:9](-[c:11]2[cH:12][c:13]([C:17]([F:18])([F:19])[F:20])[cH:14][cH:15][cH:16]2)[cH:10]1>>[CH2:2]([CH2:3][CH2:4][c:5]1[n:6][c:7]([C:21]#[N:22])[n:8][c:9](-[c:11]2[cH:12][c:13]([C:17]([F:18])([F:19])[F:20])[cH:14][cH:15][cH:16]2)[cH:10]1)[NH:28][CH:24]([CH3:23])[CH2:25][O:26][CH3:27]Participants
8
Sources & evidence
- ORD record
- ord-90846b6fc205494fbaa254fcbd76e598
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…