1-Butanol → HCID 21559906, compound
Reaction equation
[CH2:29]([OH:30])[CH2:31][CH2:32][CH3:33].[CH3:10][O:11][c:12]1[cH:13][c:14]([CH2:15][NH2:16])[cH:17][cH:18][c:19]1[O:20][CH3:21].[CH3:22][CH2:23][N:24]([CH2:25][CH3:26])[CH2:27][CH3:28].[CH3:35][OH:36].[Cl:1][c:2]1[n:3][cH:4][n:5][c:6]([Cl:9])[c:7]1[NH2:8].[OH2:34].[OH2:37]>>[c:2]1([NH:16][CH2:15][c:14]2[cH:13][c:12]([O:11][CH3:10])[c:19]([O:20][CH3:21])[cH:18][cH:17]2)[n:3][cH:4][n:5][c:6]([Cl:9])[c:7]1[NH2:8]Participants
7
Sources & evidence
- ORD record
- ord-ec5dec2093ee4c5a81c53f62f1b84fe3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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