Reaction equation
[CH2:1]([CH3:2])[C:3]1([CH:7]([CH2:8][CH2:9][OH:10])[OH:11])[CH2:4][CH2:5][CH2:6]1.[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[CH3:45][CH2:46][CH2:47][CH2:48][N+:49]([CH2:50][CH2:51][CH2:52][CH3:53])([CH2:54][CH2:55][CH2:56][CH3:57])[CH2:58][CH2:59][CH2:60][CH3:61].[Cl-:44].[Na+:13].[OH-:12].[OH2:62].[S:14]([Cl:15])([c:16]1[cH:17][cH:18][c:19]([CH3:20])[cH:21][cH:22]1)(=[O:23])=[O:24].[c:25]1(-[n:31]2[n:32][n:33][n:34][c:35]2[SH:36])[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[CH2:1]([CH3:2])[C:3]1([CH:7]([CH2:8][CH2:9][S:36][c:35]2[n:31](-[c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[n:32][n:33][n:34]2)[OH:11])[CH2:4][CH2:5][CH2:6]1Participants
10
Sources & evidence
- ORD record
- ord-e5d33fe258a7465e8dd39936d83d7852
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Linked notes
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