Acetic Acid → HCID 22714146, compound
Reaction equation
[C:33]([CH3:34])(=[O:35])[OH:36].[CH3:37][CH2:38][N:39]=[C:40]=[N:41][CH2:42][CH2:43][CH2:44][N:45]([CH3:46])[CH3:47].[CH3:53][N:54]([c:55]1[cH:56][cH:57][n:58][cH:59][cH:60]1)[CH3:61].[CH3:62][CH2:63][O:64][C:65]([CH3:66])=[O:67].[NH2:1][c:2]1[c:3]2[c:4]3[c:5]([c:6](=[O:28])[n:7]([CH:12]4[CH2:13][CH:14]([CH2:18][NH:19][C:20]([c:21]5[cH:22][cH:23][cH:24][cH:25][cH:26]5)=[O:27])[CH2:15][CH2:16][CH2:17]4)[c:8]2[cH:9][cH:10][cH:11]1)[c:29]([CH3:32])[o:30][n:31]3.[O:48]=[CH:49][N:50]([CH3:51])[CH3:52]>>[NH:1]([c:2]1[c:3]2[c:4]3[c:5]([c:6](=[O:28])[n:7]([CH:12]4[CH2:13][CH:14]([CH2:18][NH:19][C:20]([c:21]5[cH:22][cH:23][cH:24][cH:25][cH:26]5)=[O:27])[CH2:15][CH2:16][CH2:17]4)[c:8]2[cH:9][cH:10][cH:11]1)[c:29]([CH3:32])[o:30][n:31]3)[C:33]([CH3:34])=[O:35]Participants
7
Sources & evidence
- ORD record
- ord-37f5648c2c5147a6ba20c441f181c978
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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