Ethanol → 1-(4-aminophenyl)-3-isobutyl-3-azabicYclo[3.1.1]heptane-2,4-dione
Reaction equation
[CH2:1]([CH:2]([CH3:3])[CH3:4])[N:5]1[C:6](=[O:22])[C:7]2([c:13]3[cH:14][cH:15][c:16]([N+:19]([O-:20])=[O:21])[cH:17][cH:18]3)[CH2:8][CH:9]([C:10]1=[O:11])[CH2:12]2.[CH3:23][CH2:24][OH:25]>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[N:5]1[C:6](=[O:22])[C:7]2([c:13]3[cH:14][cH:15][c:16]([NH2:19])[cH:17][cH:18]3)[CH2:8][CH:9]([C:10]1=[O:11])[CH2:12]2Participants
3
Sources & evidence
- ORD record
- ord-c871f5c0f9e2442bbbe3bddad59a2e10
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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