Acetic Acid → HCID 11254863, compound
Reaction equation
[C:22]([BH3-:23])#[N:24].[CH2:17]1[CH2:18][CH2:19][NH:20][CH2:21]1.[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH3:6])[S:7][c:8]1[n:9][c:10]([CH3:16])[cH:11][c:12]([CH:14]=[O:15])[n:13]1.[CH3:26][CH2:27][OH:28].[CH3:29][C:30](=[O:31])[OH:32].[Na+:25]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH3:6])[S:7][c:8]1[n:9][c:10]([CH3:16])[cH:11][c:12]([CH2:14][N:20]2[CH2:19][CH2:18][CH2:17][CH2:21]2)[n:13]1Participants
7
Sources & evidence
- ORD record
- ord-a19f16de5f864580a0cec2a2a83063ef
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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