Acetone → HCID 19822256, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]2[c:12]([cH:13][c:14]1[C:15]([CH3:16])([CH3:17])[CH3:18])[O:11][C:10]([CH3:19])([CH2:20][O:21][c:22]1[c:23]([CH3:29])[cH:24][cH:25][c:26]([NH2:28])[cH:27]1)[CH2:9][C:8]2=[O:30].[C:36]([CH:37]=[CH2:38])(=[O:39])[O:40][CH2:41][CH3:42].[CH3:43][C:44](=[O:45])[CH3:46].[ClH:35].[N:31]([O-:32])=[O:33].[Na+:34]>>[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]2[c:12]([cH:13][c:14]1[C:15]([CH3:16])([CH3:17])[CH3:18])[O:11][C:10]([CH3:19])([CH2:20][O:21][c:22]1[c:23]([CH3:29])[cH:24][cH:25][c:26]([CH2:38][CH:37]([Cl:35])[C:36](=[O:39])[O:40][CH2:41][CH3:42])[cH:27]1)[CH2:9][C:8]2=[O:30]Participants
7
Sources & evidence
- ORD record
- ord-6454b578dc344825b0986441d634be30
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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