Ammonia → 1-(2-(6-amino-8-(3-fluorophenyl)-9-methyl-9H-2-purinyl)-1-ethynyl)-1-cyclopentanol
Reaction equation
[CH2:28]([CH2:29][O:30][CH3:31])[O:32][CH3:33].[CH3:34][CH2:35][O:36][C:37](=[O:38])[CH3:39].[Cl:1][c:2]1[c:3]2[n:4][c:5](-[c:20]3[cH:21][c:22]([F:26])[cH:23][cH:24][cH:25]3)[n:6]([CH3:19])[c:7]2[n:8][c:9]([C:11]#[C:12][C:13]2([OH:18])[CH2:14][CH2:15][CH2:16][CH2:17]2)[n:10]1.[NH3:27]>>[c:2]1([NH2:27])[c:3]2[n:4][c:5](-[c:20]3[cH:21][c:22]([F:26])[cH:23][cH:24][cH:25]3)[n:6]([CH3:19])[c:7]2[n:8][c:9]([C:11]#[C:12][C:13]2([OH:18])[CH2:14][CH2:15][CH2:16][CH2:17]2)[n:10]1Participants
5
Sources & evidence
- ORD record
- ord-6c200ff8ed7e4a45b87bd8ae5a5b0ab1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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