Ethanol → HCID 14677570, compound
Reaction equation
[Br:1][CH2:2][CH:3]=[CH2:4].[C:34](=[O:35])([O-:36])[OH:37].[C:5]([OH:6])(=[O:7])[C:8]([OH:9])=[O:10].[CH3:11][c:12]1[cH:13][cH:14][c:15]([CH2:17][n:18]2[c:19]([NH:27][CH:28]3[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]3)[n:20][c:21]3[c:22]2[n:23][cH:24][cH:25][cH:26]3)[o:16]1.[CH3:39][CH2:40][OH:41].[Na+:38]>>[CH2:2]=[CH:3][CH2:4][N:31]1[CH2:30][CH2:29][CH:28]([NH:27][c:19]2[n:18]([CH2:17][c:15]3[cH:14][cH:13][c:12]([CH3:11])[o:16]3)[c:22]3[c:21]([n:20]2)[cH:26][cH:25][cH:24][n:23]3)[CH2:33][CH2:32]1Participants
7
Sources & evidence
- ORD record
- ord-a697ab2e15954e7fb098bfcdfd818d83
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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