Ethanol → HCID 66673983, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]1[C:9]([CH2:22][CH3:23])([CH2:24][CH3:25])[c:10]2[cH:11][c:12]([C:20]#[N:21])[cH:13][cH:14][c:15]2[CH2:16][CH:17]1[O:18][CH3:19])=[O:26].[CH3:27][CH2:28][OH:29].[O:30]=[CH:31][N:32]([CH3:33])[CH3:34].[OH2:35]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]1[C:9]([CH2:22][CH3:23])([CH2:24][CH3:25])[c:10]2[cH:11][c:12]([C:20]([NH2:21])=[O:29])[cH:13][cH:14][c:15]2[CH2:16][CH:17]1[O:18][CH3:19])=[O:26]Participants
5
Sources & evidence
- ORD record
- ord-9206ac7ff82d4b9f93734e5ef9de093e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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