Hydrochloric Acid → 6-Amino-2-(butylamino)-9-[3-(tetrahydro-2H-pyran-3-yl)propyl]-7,9-dihydro-8H-Purin-8-one
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[NH:5][c:6]1[n:7][c:8]([NH2:26])[c:9]2[n:10][c:11]([O:24][CH3:25])[n:12]([CH2:15][CH2:16][CH2:17][CH:18]3[CH2:19][O:20][CH2:21][CH2:22][CH2:23]3)[c:13]2[n:14]1.[CH2:33]1[O:34][CH2:35][CH2:36][O:37][CH2:38]1.[CH3:31][OH:32].[ClH:27].[Na+:29].[OH-:28].[OH2:30]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[NH:5][c:6]1[n:7][c:8]([NH2:26])[c:9]2[nH:10][c:11](=[O:24])[n:12]([CH2:15][CH2:16][CH2:17][CH:18]3[CH2:19][O:20][CH2:21][CH2:22][CH2:23]3)[c:13]2[n:14]1Participants
8
Sources & evidence
- ORD record
- ord-545f662f43144101aa4acc5ea61699a2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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