Acetone → HCID 19822190, 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]([CH2:16][C:17]([CH3:18])([CH3:19])[CH3:20])([CH3:21])[CH3:22])[O:11][C:10]([CH3:23])([CH2:24][O:25][c:26]1[cH:27][cH:28][c:29]([NH2:32])[cH:30][cH:31]1)[CH2:9][C:8]2=[O:33].[C:39]([CH:40]=[CH2:41])(=[O:42])[O:43][CH2:44][CH3:45].[CH3:47][C:48](=[O:49])[CH3:50].[ClH:38].[N:34]([O-:35])=[O:36].[Na+:37].[OH2:46]>>[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]([CH2:16][C:17]([CH3:18])([CH3:19])[CH3:20])([CH3:21])[CH3:22])[O:11][C:10]([CH3:23])([CH2:24][O:25][c:26]1[cH:27][cH:28][c:29]([CH2:41][CH:40]([Cl:38])[C:39](=[O:42])[O:43][CH2:44][CH3:45])[cH:30][cH:31]1)[CH2:9][C:8]2=[O:33]Participants
8
Sources & evidence
- ORD record
- ord-c5c73072621a4e99870df839c2e870a6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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