Acetic Acid → HCID 178494757, compound
Reaction equation
[CH3:28][C:29](=[O:30])[OH:31].[CH:1]1([CH:4]([CH2:5][O:6][CH3:7])[n:8]2[cH:9][c:10]([C:26]#[N:27])[n:11][c:12]([NH:15][c:16]3[c:17]([CH3:25])[n:18][c:19]([O:23][CH3:24])[c:20]([CH3:22])[cH:21]3)[c:13]2=[O:14])[CH2:2][CH2:3]1>>[CH:1]1([CH:4]([CH2:5][O:6][CH3:7])[n:8]2[cH:9][c:10]([C:26]#[N:27])[n:11][c:12]([NH:15][c:16]3[c:17]([CH3:25])[n:18][c:19]([OH:23])[c:20]([CH3:22])[cH:21]3)[c:13]2=[O:14])[CH2:2][CH2:3]1Participants
3
Sources & evidence
- ORD record
- ord-d542f8bf2b5b44d8b5fa2e4c7b670f10
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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