Acetone → HCID 60139865, 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:50](=[O:51])([O-:52])[O-:53].[CH3:29][C:30]([CH3:31])=[O:32].[CH3:47][C:48]#[N:49].[NH2:1][CH2:2][CH2:3][CH2:4][C:5]1([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[O:6][C:7]([c:15]2[c:16]([F:22])[cH:17][cH:18][c:19]([F:21])[cH:20]2)=[N:8][N:9]1[C:10]([CH:11]([CH3:12])[CH3:13])=[O:14].[Na+:46].[Na+:54].[Na+:55]>>[NH:1]([CH2:2][CH2:3][CH2:4][C:5]1([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[O:6][C:7]([c:15]2[c:16]([F:22])[cH:17][cH:18][c:19]([F:21])[cH:20]2)=[N:8][N:9]1[C:10]([CH:11]([CH3:12])[CH3:13])=[O:14])[CH:30]([CH3:29])[CH3:31]Participants
7
Sources & evidence
- ORD record
- ord-33850fd9d0bc4884b8bef14c6df48ff7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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