Ethanol → HCID 178492594, compound
Reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([C:13]([CH:14]([CH3:15])[N:16]2[CH2:17][CH2:18][CH:19]([N:22]3[C:23](=[N:32][C:33]#[N:34])[NH:24][c:25]4[cH:26][cH:27][cH:28][cH:29][c:30]4[CH2:31]3)[CH2:20][CH2:21]2)=[O:35])[cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10].[CH3:36][CH2:37][OH:38]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:13]([CH:14]([CH3:15])[N:16]2[CH2:17][CH2:18][CH:19]([N:22]3[C:23](=[N:32][C:33]#[N:34])[NH:24][c:25]4[cH:26][cH:27][cH:28][cH:29][c:30]4[CH2:31]3)[CH2:20][CH2:21]2)[OH:35])[cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10]Participants
3
Sources & evidence
- ORD record
- ord-4b8b0b5581154d3ab172b6812f3ba4b1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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