Hydrochloric Acid → [3,4,5-triacetyloxy-6-[4-chloro-3-[[5-[4-(methanesulfonamido)phenyl]thiophen-2-yl]methyl]phenyl]oxan-2-yl]methyl acetate
Reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH:6]([c:24]2[cH:25][c:26]([CH2:31][c:32]3[s:33][c:34](-[c:37]4[cH:38][cH:39][c:40]([NH2:43])[cH:41][cH:42]4)[cH:35][cH:36]3)[c:27]([Cl:30])[cH:28][cH:29]2)[O:7][CH:8]([CH2:19][O:20][C:21]([CH3:22])=[O:23])[CH:9]([O:15][C:16]([CH3:17])=[O:18])[CH:10]1[O:11][C:12]([CH3:13])=[O:14].[CH3:44][S:45]([Cl:46])(=[O:47])=[O:48].[Cl:56][CH2:57][Cl:58].[ClH:55].[cH:49]1[cH:50][cH:51][n:52][cH:53][cH:54]1>>[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH:6]([c:24]2[cH:25][c:26]([CH2:31][c:32]3[s:33][c:34](-[c:37]4[cH:38][cH:39][c:40]([NH:43][S:45]([CH3:44])(=[O:47])=[O:48])[cH:41][cH:42]4)[cH:35][cH:36]3)[c:27]([Cl:30])[cH:28][cH:29]2)[O:7][CH:8]([CH2:19][O:20][C:21]([CH3:22])=[O:23])[CH:9]([O:15][C:16]([CH3:17])=[O:18])[CH:10]1[O:11][C:12]([CH3:13])=[O:14]Participants
6
Sources & evidence
- ORD record
- ord-993c437755c34d4faeb48791ffd5162b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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