Acetic Acid → HCID 67311514, compound
Reaction equation
[CH3:23][O:24][CH2:25][CH2:26][NH2:27].[CH3:38][N:39]([c:40]1[cH:41][cH:42][n:43][cH:44][cH:45]1)[CH3:46].[CH3:52][C:53](=[O:54])[OH:55].[CH:14]([N:15]=[C:16]=[N:17][CH:18]([CH3:19])[CH3:20])([CH3:21])[CH3:22].[CH:1](=[O:2])[c:3]1[cH:4][cH:5][c:6]([CH:7]=[CH:8][C:9](=[O:10])[OH:11])[cH:12][cH:13]1.[CH:28]([CH:29]=[CH:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)=[O:37].[O:47]=[CH:48][N:49]([CH3:50])[CH3:51]>>[CH2:1]([c:3]1[cH:4][cH:5][c:6]([CH:7]=[CH:8][C:9](=[O:10])[OH:11])[cH:12][cH:13]1)[N:27]([CH2:26][CH2:25][O:24][CH3:23])[CH2:28][CH:29]=[CH:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1Participants
8
Sources & evidence
- ORD record
- ord-aa8ef98f48e2450798b2dda4884109d9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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