Acetone → HCID 178501552, compound
Reaction equation
[Br:68][CH2:69][C:70](=[O:71])[O:72][CH3:73].[C:62](=[O:63])([O-:64])[O-:65].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH2:15][CH2:16][c:17]2[c:18]3[c:19]([n:20][cH:21][cH:22]2)[nH:23][n:24][c:25]3[O:26][CH:27]2[CH:28]([O:29][C:30]([C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH:36]([O:37][C:38]([C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43])[CH:44]([O:45][C:46]([C:47]([CH3:48])([CH3:49])[CH3:50])=[O:51])[CH:52]([CH2:54][O:55][C:56]([C:57]([CH3:58])([CH3:59])[CH3:60])=[O:61])[O:53]2)[cH:13][cH:14]1.[CH3:76][C:77](=[O:78])[CH3:79].[Cs+:66].[Cs+:67].[I-:75].[Na+:74]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH2:15][CH2:16][c:17]2[c:18]3[c:19]([n:20][cH:21][cH:22]2)[n:23]([CH2:69][C:70](=[O:71])[O:72][CH3:73])[n:24][c:25]3[O:26][CH:27]2[CH:28]([O:29][C:30]([C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH:36]([O:37][C:38]([C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43])[CH:44]([O:45][C:46]([C:47]([CH3:48])([CH3:49])[CH3:50])=[O:51])[CH:52]([CH2:54][O:55][C:56]([C:57]([CH3:58])([CH3:59])[CH3:60])=[O:61])[O:53]2)[cH:13][cH:14]1Participants
8
Sources & evidence
- ORD record
- ord-ea037177d9f9461e98155dffb018a7b4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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