Hydrogen Bromide → 1,3-Di-cyclohexylmethyl-8-bromo xanthine
Reaction equation
[BrH:29].[CH:1]1([CH2:7][n:8]2[c:9](=[O:10])[n:11]([CH2:22][CH:23]3[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]3)[c:12]3[n:13][c:14]([N+:19]([O-:20])=[O:21])[nH:15][c:16]3[c:17]2=[O:18])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1>>[CH:1]1([CH2:7][n:8]2[c:9](=[O:10])[n:11]([CH2:22][CH:23]3[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]3)[c:12]3[n:13][c:14]([Br:29])[nH:15][c:16]3[c:17]2=[O:18])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
3
Sources & evidence
- ORD record
- ord-06a891b318bc4e7fbd5570b1dd61fb44
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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