Acetic Acid → HCID 72575119, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[CH:11]([CH2:12][c:13]1[cH:14][cH:15][c:16]([O:17][c:18]2[cH:19][cH:20][c:21]([C:22](=[O:23])[OH:24])[cH:25][cH:26]2)[cH:27][cH:28]1)[NH:29][C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36].[CH3:37][N:38]1[CH2:39][CH2:40][O:41][CH2:42][CH2:43]1.[CH3:47][C:48](=[O:49])[OH:50].[CH3:51][N:52]([CH3:53])[CH:54]=[O:55].[ClH:44].[NH2:45][OH:46]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[CH:11]([CH2:12][c:13]1[cH:14][cH:15][c:16]([O:17][c:18]2[cH:19][cH:20][c:21]([C:22](=[O:23])[NH:45][OH:46])[cH:25][cH:26]2)[cH:27][cH:28]1)[NH:29][C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36]Participants
7
Sources & evidence
- ORD record
- ord-faebec58f6db40349e0aa35b847c4e62
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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