Acetic Acid → HCID 59118272, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][c:6]2[c:7]([cH:11][cH:12]1)[O:8][CH2:9][CH2:10]2.[CH3:13][O:14][C:15](=[O:16])[CH2:17][C:18]#[N:19].[CH3:28][C:29](=[O:30])[OH:31].[CH3:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[NH2:20][CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[C:1]([CH3:2])([c:4]1[cH:5][c:6]2[c:7]([cH:11][cH:12]1)[O:8][CH2:9][CH2:10]2)=[C:17]([C:15]([O:14][CH3:13])=[O:16])[C:18]#[N:19]Participants
6
Sources & evidence
- ORD record
- ord-5659a92ebf774eefbfc9f2efb0976377
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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