Acetone → HCID 18407199, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]([c:5]1[c:6]([O:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:7][cH:8][cH:9][cH:10]1)[CH2:18][c:19]1[c:20]([CH:25]2[O:26][CH2:29][CH2:28][O:27]2)[cH:21][cH:22][cH:23][cH:24]1.[C:42](=[O:43])([OH:44])[O-:45].[CH3:47][C:48](=[O:49])[CH3:50].[Na+:46].[OH2:30].[c:31]1([CH3:32])[cH:33][cH:34][c:35]([S:36]([OH:37])(=[O:38])=[O:39])[cH:40][cH:41]1>>[C:1]([CH3:2])(=[O:3])[N:4]([c:5]1[c:6]([O:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:7][cH:8][cH:9][cH:10]1)[CH2:18][c:19]1[c:20]([CH:25]=[O:26])[cH:21][cH:22][cH:23][cH:24]1Participants
7
Sources & evidence
- ORD record
- ord-7aa037b2b05249d3a5152f4911dfbe84
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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