Ethanol → 1,3-Dipropyl-8-(1-hydroxycyclopent-3-yl)xanthine
Reaction equation
[CH2:1]([CH2:2][CH3:3])[n:4]1[c:5](=[O:6])[n:7]([CH2:21][CH2:22][CH3:23])[c:8]2[n:9][c:10]([CH:15]3[CH2:16][C:17](=[O:20])[CH2:18][CH2:19]3)[nH:11][c:12]2[c:13]1=[O:14].[CH3:24][CH2:25][OH:26]>>[CH2:1]([CH2:2][CH3:3])[n:4]1[c:5](=[O:6])[n:7]([CH2:21][CH2:22][CH3:23])[c:8]2[n:9][c:10]([CH:15]3[CH2:16][CH:17]([OH:20])[CH2:18][CH2:19]3)[nH:11][c:12]2[c:13]1=[O:14]Participants
3
Sources & evidence
- ORD record
- ord-739eec7670bc40a8b487e06df10cfcf5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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