Trifluoroacetic acid → 3-Amino-5-[2-chloro-6-[(1-hydroxy-3-phenylpropan-2-yl)amino]purin-9-yl]cyclopentane-1,2-diol
Reaction equation
[Cl:41][c:42]1[n:43][c:44]([NH:73][CH:74]([CH2:75][c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[CH2:82][OH:83])[c:45]2[n:46][cH:47][n:48]([CH:51]3[CH:52]([OH:72])[CH:53]([OH:71])[CH:54]([N:56]([C:57]([O:58][C:59]([CH3:60])([CH3:61])[CH3:62])=[O:63])[C:64]([O:65][C:66]([CH3:67])([CH3:68])[CH3:69])=[O:70])[CH2:55]3)[c:49]2[n:50]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[NH2:8][CH:9]1[CH2:10][CH:11]([n:12]2[cH:13][n:14][c:15]3[c:16]2[n:17][c:18]([Cl:19])[n:20][c:21]3[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)[CH:37]([OH:38])[CH:39]1[OH:40]>>[Cl:41][c:42]1[n:43][c:44]([NH:73][CH:74]([CH2:75][c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[CH2:82][OH:83])[c:45]2[n:46][cH:47][n:48]([CH:51]3[CH:52]([OH:72])[CH:53]([OH:71])[CH:54]([NH2:56])[CH2:55]3)[c:49]2[n:50]1Participants
4
Sources & evidence
- ORD record
- ord-6b925cb54d6c46a1881eeeb6d6e51ea4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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