Acetone → HCID 22347376, compound
Reaction equation
[CH3:39][C:40](=[O:41])[CH3:42].[ClH:1].[NH2:2][c:3]1[c:4]2[c:5]([n:6][cH:7][n:8]1)[n:9]([CH:25]1[CH2:26][CH2:27][N:28]([CH2:31][C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:29][CH2:30]1)[n:10][c:11]2-[c:12]1[cH:13][cH:14][c:15]([O:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:16][cH:17]1>>[NH2:2][c:3]1[c:4]2[c:5]([n:6][cH:7][n:8]1)[n:9]([CH:25]1[CH2:26][CH2:27][N:28]([CH2:31][C:32](=[O:33])[OH:34])[CH2:29][CH2:30]1)[n:10][c:11]2-[c:12]1[cH:13][cH:14][c:15]([O:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:16][cH:17]1Participants
4
Sources & evidence
- ORD record
- ord-36ef1c70bd9a4364b3dcee3e9a6f7c05
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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