Acetate → HCID 173159035, compound
Reaction equation
[CH3:1][C:2]1([CH3:20])[CH2:3][C:4](=[O:19])[c:5]2[cH:6][cH:7][c:8](-[c:11]3[cH:12][cH:13][c:14]([C:17]#[N:18])[n:15]3[CH3:16])[cH:9][c:10]21.[CH3:22][C:23](=[O:24])[O-:25].[CH3:29][CH2:30][OH:31].[ClH:26].[NH2:27][OH:28].[Na+:21].[OH2:32]>>[CH3:1][C:2]1([CH3:20])[CH2:3][C:4](=[N:27][OH:28])[c:5]2[cH:6][cH:7][c:8](-[c:11]3[cH:12][cH:13][c:14]([C:17]#[N:18])[n:15]3[CH3:16])[cH:9][c:10]21Participants
8
Sources & evidence
- ORD record
- ord-cf8dee2a31e24318ad174748258a92c3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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