HCID 15230685, compound → HCID 178421736, compound
Reaction equation
[I:1][CH2:2][C:3]([CH:4]1[CH:5]([CH3:24])[CH2:6][CH:7]2[CH:8]3[CH2:9][CH2:10][C:11]4=[CH:12][C:13](=[O:23])[CH:14]=[CH:15][C:16]4([CH3:17])[C:18]3=[CH:19][CH2:20][C:21]12[CH3:22])=[O:25].[n:26]1[c:27](-[c:32]2[n:33][c:34]([N:44]3[CH2:45][CH2:46][NH:47][CH2:48][CH2:49]3)[n:35][c:36](-[c:38]3[n:39][cH:40][cH:41][cH:42][cH:43]3)[n:37]2)[cH:28][cH:29][cH:30][cH:31]1>>[CH2:2]([C:3]([CH:4]1[CH:5]([CH3:24])[CH2:6][CH:7]2[CH:8]3[CH2:9][CH2:10][C:11]4=[CH:12][C:13](=[O:23])[CH:14]=[CH:15][C:16]4([CH3:17])[C:18]3=[CH:19][CH2:20][C:21]12[CH3:22])=[O:25])[N:47]1[CH2:46][CH2:45][N:44]([c:34]2[n:33][c:32](-[c:27]3[n:26][cH:31][cH:30][cH:29][cH:28]3)[n:37][c:36](-[c:38]3[n:39][cH:40][cH:41][cH:42][cH:43]3)[n:35]2)[CH2:49][CH2:48]1Participants
3
Sources & evidence
- ORD record
- ord-478c6f111d3542e2b458e65d6653ee8c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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