Ethanol → HCID 9925134, compound
Reaction equation
[CH2:1]([CH2:2][CH3:3])[N:4]([C:5]1([c:8]2[cH:9][cH:10][c:11]([C:14]#[C:15][c:16]3[cH:17][cH:18][c:19]([C:20](=[O:21])[O:22][CH2:23][CH3:24])[cH:25][cH:26]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1)[CH2:27][CH2:28][CH3:29].[CH3:32][CH2:33][OH:34].[Na+:31].[O:35]1[CH2:36][CH2:37][CH2:38][CH2:39]1.[OH-:30]>>[CH2:1]([CH2:2][CH3:3])[N:4]([C:5]1([c:8]2[cH:9][cH:10][c:11]([C:14]#[C:15][c:16]3[cH:17][cH:18][c:19]([C:20](=[O:21])[OH:22])[cH:25][cH:26]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1)[CH2:27][CH2:28][CH3:29]Participants
6
Sources & evidence
- ORD record
- ord-599934d657e14b69bc585d9cc7f5a0dd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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