1,1,1-Trichloroethane → [4-Benzoyloxy-5-[6-(2,2-diphenylethylamino)-2-[(2-piperidin-1-ylethylcarbamoylamino)methyl]purin-9-yl]-2-(ethylcarbamoyl)oxolan-3-yl] benzoate
Reaction equation
[C:38]([c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)(=[O:45])[O:46][CH:47]1[CH:48]([C:65](=[O:66])[NH:67][CH2:68][CH3:69])[O:49][CH:50]([O:61][C:62](=[O:63])[CH3:64])[CH:51]1[O:52][C:53]([c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1)=[O:60].[C:70]([O:71][CH:72]1[CH:73]([O:74][C:75](=[O:76])[c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[CH:83]([O:84][C:85](=[O:86])[CH3:87])[O:88][CH:89]1[C:90]([NH:91][CH2:92][CH3:93])=[O:94])(=[O:95])[c:96]1[cH:97][cH:98][cH:99][cH:100][cH:101]1.[CH3:102][Si:103]([O:104][S:105]([C:106]([F:107])([F:108])[F:109])(=[O:110])=[O:111])([CH3:112])[CH3:113].[CH3:114][C:115]([Cl:116])([Cl:117])[Cl:118].[CH3:119][CH2:120][O:121][C:122](=[O:123])[CH3:124].[c:1]1([CH:7]([CH2:8][NH:9][c:10]2[c:11]3[n:12][cH:13][nH:14][c:15]3[n:16][c:17]([CH2:19][NH:20][C:21](=[O:22])[NH:23][CH2:24][CH2:25][N:26]3[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]3)[n:18]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([CH2:8][NH:9][c:10]2[c:11]3[n:12][cH:13][n:14]([CH:50]4[O:49][CH:48]([C:65](=[O:66])[NH:67][CH2:68][CH3:69])[CH:47]([O:46][C:38]([c:39]5[cH:40][cH:41][cH:42][cH:43][cH:44]5)=[O:45])[CH:51]4[O:52][C:53]([c:54]4[cH:55][cH:56][cH:57][cH:58][cH:59]4)=[O:60])[c:15]3[n:16][c:17]([CH2:19][NH:20][C:21](=[O:22])[NH:23][CH2:24][CH2:25][N:26]3[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]3)[n:18]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-1a529f65f85c462ba113fe37d86985c4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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