Ethanol → HCID 22261224, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][c:7]1[c:8]([CH2:27][O:28][C:29]([NH:30][CH:31]2[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]2)=[O:37])[cH:9][c:10]([O:13][CH2:14][CH2:15][c:16]2[n:17][c:18](-[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[o:19][cH:20]2)[cH:11][cH:12]1)=[O:38].[CH3:41][CH2:42][OH:43].[Na+:40].[OH-:39]>>[O:3]=[C:4]([CH2:5][CH2:6][c:7]1[c:8]([CH2:27][O:28][C:29]([NH:30][CH:31]2[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]2)=[O:37])[cH:9][c:10]([O:13][CH2:14][CH2:15][c:16]2[n:17][c:18](-[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[o:19][cH:20]2)[cH:11][cH:12]1)[OH:38]Participants
5
Sources & evidence
- ORD record
- ord-108c62be73ea4a459d5925db2eb996a8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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