7-allyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione → 7-Allyl-1-(5-hydroxy-5-methylhexyl)-3-methylxanthine
Reaction equation
[CH2:1]([CH:2]=[CH2:3])[n:4]1[cH:5][n:6][c:7]2[n:8]([CH3:15])[c:9](=[O:14])[nH:10][c:11](=[O:13])[c:12]12.[Cl:16][CH2:17][CH2:18][CH2:19][CH2:20][C:21]([CH3:22])([CH3:23])[OH:24]>>[CH2:1]([CH:2]=[CH2:3])[n:4]1[cH:5][n:6][c:7]2[n:8]([CH3:15])[c:9](=[O:14])[n:10]([CH2:17][CH2:18][CH2:19][CH2:20][C:21]([CH3:22])([CH3:23])[OH:24])[c:11](=[O:13])[c:12]12Participants
3
Sources & evidence
- ORD record
- ord-b2e704dc906e4952a6bfbafd27608c44
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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