1-Butanol → HCID 11177264, compound
Reaction equation
[CH2:35]([OH:36])[CH2:37][CH2:38][CH3:39].[CH3:18][N:19]([CH3:20])[CH2:21][CH:22]([CH2:23][O:24][c:25]1[cH:26][cH:27][c:28]([NH2:29])[cH:30][cH:31]1)[OH:32].[CH3:33][OH:34].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]([NH:8][c:9]2[c:10]([CH3:16])[cH:11][cH:12][c:13]([CH3:15])[cH:14]2)[n:7]1.[ClH:17]>>[c:2]1([NH:29][c:28]2[cH:27][cH:26][c:25]([O:24][CH2:23][CH:22]([CH2:21][N:19]([CH3:18])[CH3:20])[OH:32])[cH:31][cH:30]2)[n:3][cH:4][cH:5][c:6]([NH:8][c:9]2[c:10]([CH3:16])[cH:11][cH:12][c:13]([CH3:15])[cH:14]2)[n:7]1Participants
6
Sources & evidence
- ORD record
- ord-0fb99bfa767e4799b5488028c8e234bb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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