Ethanol → 2-[6-Amino-2-(2-cyclohexylethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Reaction equation
[CH2:33]1[O:34][CH:35]1[CH3:36].[CH3:30][CH2:31][OH:32].[CH:21]1([CH2:27][CH2:28][NH2:29])[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]1.[Cl:1][c:2]1[n:3][c:4]([NH2:20])[c:5]2[n:6][cH:7][n:8]([CH:9]3[CH:10]([OH:11])[CH:12]([OH:13])[CH:14]([CH2:15][OH:16])[O:17]3)[c:18]2[n:19]1>>[c:2]1([NH:29][CH2:28][CH2:27][CH:21]2[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]2)[n:3][c:4]([NH2:20])[c:5]2[n:6][cH:7][n:8]([CH:9]3[CH:10]([OH:11])[CH:12]([OH:13])[CH:14]([CH2:15][OH:16])[O:17]3)[c:18]2[n:19]1Participants
5
Sources & evidence
- ORD record
- ord-9691cc47d9224466a154f355fa5288e2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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