Acetic Acid → 2-(5-Amino-2-propoxyphenyl)-purin-6-one
Reaction equation
[CH2:1]([CH2:2][CH3:3])[O:4][c:5]1[c:6]([C:14]2=[N:15][C:16](=[O:23])[C:17]3=[N:18][CH:19]=[N:20][C:21]3=[N:22]2)[cH:7][c:8]([N+:11]([O-:12])=[O:13])[cH:9][cH:10]1.[CH3:26][C:27](=[O:28])[OH:29].[Na+:25].[OH-:24].[OH2:30]>>[CH2:1]([CH2:2][CH3:3])[O:4][c:5]1[c:6]([C:14]2=[N:15][C:16](=[O:23])[C:17]3=[N:18][CH:19]=[N:20][C:21]3=[N:22]2)[cH:7][c:8]([NH2:11])[cH:9][cH:10]1Participants
6
Sources & evidence
- ORD record
- ord-fc7627b486a642bd9c9d253100ab79d8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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