Acetate → HCID 473918, compound
Reaction equation
[CH3:1][c:2]1[cH:3][c:4]([S:9][c:10]2[c:11]([CH:18]([CH3:19])[CH3:20])[n:12][c:13]([CH:16]=[O:17])[n:14]2[CH3:15])[cH:5][c:6]([CH3:8])[cH:7]1.[CH3:25][C:26](=[O:27])[O-:28].[CH3:30][CH2:31][OH:32].[ClH:21].[NH2:22][OH:23].[Na+:24].[OH2:29]>>[CH3:1][c:2]1[cH:3][c:4]([S:9][c:10]2[c:11]([CH:18]([CH3:19])[CH3:20])[n:12][c:13]([CH:16]=[N:22][OH:23])[n:14]2[CH3:15])[cH:5][c:6]([CH3:8])[cH:7]1Participants
8
Sources & evidence
- ORD record
- ord-31cba75d54aa4cf588ae9de76f1784e0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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