Acetic Acid → HCID 21545569, compound
Reaction equation
[CH3:31][C:32](=[O:33])[OH:34].[NH3:30].[OH2:29].[OH:1][CH:2]([CH2:3][N:4]1[CH2:5][CH2:6][N:7]([c:10]2[c:11]([O:16][CH3:17])[cH:12][cH:13][cH:14][cH:15]2)[CH2:8][CH2:9]1)[CH2:18][S:19][c:20]1[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]1.[OH:27][OH:28]>>[OH:1][CH:2]([CH2:3][N:4]1[CH2:5][CH2:6][N:7]([c:10]2[c:11]([O:16][CH3:17])[cH:12][cH:13][cH:14][cH:15]2)[CH2:8][CH2:9]1)[CH2:18][S:19]([c:20]1[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]1)=[O:27]Participants
6
Sources & evidence
- ORD record
- ord-03e5399d2f5d49ccb707e3bdeb10d384
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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