Ethanol → HCID 21283540, compound
Reaction equation
[CH3:26][CH2:27][OH:28].[Na+:2].[OH-:1].[OH2:25].[OH:23][OH:24].[n:3]1[cH:4][cH:5][c:6]([N:9]2[CH2:10][CH2:11][N:12]([c:15]3[cH:16][cH:17][c:18]([C:19]#[N:20])[cH:21][cH:22]3)[CH2:13][CH2:14]2)[cH:7][cH:8]1>>[O:1]=[C:19]([c:18]1[cH:17][cH:16][c:15]([N:12]2[CH2:11][CH2:10][N:9]([c:6]3[cH:5][cH:4][n:3][cH:8][cH:7]3)[CH2:14][CH2:13]2)[cH:22][cH:21]1)[NH2:20]Participants
7
Sources & evidence
- ORD record
- ord-6fe5f39d1e12436c9c009a67362ec85f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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