Acetic Acid → 2-[6-(2,2-Diphenylethylamino)-2-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]purin-9-yl]-5-(methoxymethyl)oxolane-3,4-diol
Reaction equation
[C:41]([O:42][BH-:43]([O:44][C:45](=[O:46])[CH3:47])[O:48][C:49](=[O:50])[CH3:51])(=[O:52])[CH3:53].[CH3:37][C:38](=[O:39])[OH:40].[NH2:1][CH2:2][c:3]1[n:4][c:5]([NH:22][CH2:23][CH:24]([c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:6]2[n:7][cH:8][n:9]([CH:12]3[O:13][CH:14]([CH2:19][O:20][CH3:21])[CH:15]([OH:18])[CH:16]3[OH:17])[c:10]2[n:11]1.[Na+:54].[n:55]1[c:56]([N:61]2[CH2:62][CH2:63][C:64](=[O:67])[CH2:65][CH2:66]2)[cH:57][cH:58][cH:59][cH:60]1>>[NH:1]([CH2:2][c:3]1[n:4][c:5]([NH:22][CH2:23][CH:24]([c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:6]2[n:7][cH:8][n:9]([CH:12]3[O:13][CH:14]([CH2:19][O:20][CH3:21])[CH:15]([OH:18])[CH:16]3[OH:17])[c:10]2[n:11]1)[CH:64]1[CH2:63][CH2:62][N:61]([c:56]2[n:55][cH:60][cH:59][cH:58][cH:57]2)[CH2:66][CH2:65]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-b77da1545ed442ceada9bf874a3ed657
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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