Acetone → HCID 178500837, compound
Reaction equation
[CH2:16]([c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)[O:23][C:24](=[O:25])[NH:26][CH:27]([CH2:28][c:29]1[cH:30][cH:31][c:32]([O:35][CH2:36][c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:33][cH:34]1)[C:43](=[O:44])[OH:45].[CH2:8]([O:9][C:10]([Cl:11])=[O:12])[CH:13]([CH3:14])[CH3:15].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:47][O:48][C:49]([CH:50]([NH2:51])[CH3:52])=[O:53].[CH3:54][C:55](=[O:56])[CH3:57].[CH:58]([Cl:59])([Cl:60])[Cl:61].[ClH:46]>>[CH2:16]([c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)[O:23][C:24](=[O:25])[NH:26][CH:27]([CH2:28][c:29]1[cH:30][cH:31][c:32]([O:35][CH2:36][c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:33][cH:34]1)[C:43](=[O:44])[NH:51][CH:50]([C:49]([O:48][CH3:47])=[O:53])[CH3:52]Participants
8
Sources & evidence
- ORD record
- ord-a460ce0c0cba44a28c14e9112f0fc1cd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…