Ethanol → HCID 57460529, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][c:6](-[n:10]2[c:11]([CH3:36])[n:12][c:13]([CH2:32][CH2:33][CH2:34][CH3:35])[c:14]([CH2:17][c:18]3[cH:19][cH:20][c:21](-[c:24]4[c:25]([C:30]#[N:31])[cH:26][cH:27][cH:28][cH:29]4)[cH:22][cH:23]3)[c:15]2=[O:16])[cH:7][cH:8][cH:9]1.[CH3:37][CH2:38][O:39][C:40](=[O:41])[CH3:42].[CH3:44][CH2:45][OH:46].[OH2:43]>>[CH:1]([CH3:2])([OH:3])[c:4]1[cH:5][c:6](-[n:10]2[c:11]([CH3:36])[n:12][c:13]([CH2:32][CH2:33][CH2:34][CH3:35])[c:14]([CH2:17][c:18]3[cH:19][cH:20][c:21](-[c:24]4[c:25]([C:30]#[N:31])[cH:26][cH:27][cH:28][cH:29]4)[cH:22][cH:23]3)[c:15]2=[O:16])[cH:7][cH:8][cH:9]1Participants
5
Sources & evidence
- ORD record
- ord-df8f8b69eb574be18cbfaf1b216b0fbc
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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