Water → HCID 22033039, compound
Reaction equation
[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH2:44].[OH:1][c:2]1[cH:3][cH:4][c:5]2[c:10]([cH:11]1)[S:9][CH2:8][C:7]([CH3:12])([c:13]1[cH:14][cH:15][c:16]([OH:19])[cH:17][cH:18]1)[CH:6]2[CH2:20][CH2:21][CH2:22][O:23][c:24]1[cH:25][cH:26][c:27]([O:30][CH2:31][CH2:32][S:33][CH2:34][CH2:35][CH2:36][C:37]([C:38]([F:39])([F:40])[F:41])([F:42])[F:43])[cH:28][cH:29]1>>[OH:1][c:2]1[cH:3][cH:4][c:5]2[c:10]([cH:11]1)[S:9][CH2:8][C:7]([CH3:12])([c:13]1[cH:14][cH:15][c:16]([OH:19])[cH:17][cH:18]1)[CH:6]2[CH2:20][CH2:21][CH2:22][O:23][c:24]1[cH:25][cH:26][c:27]([O:30][CH2:31][CH2:32][S:33]([CH2:34][CH2:35][CH2:36][C:37]([C:38]([F:39])([F:40])[F:41])([F:42])[F:43])=[O:44])[cH:28][cH:29]1Participants
4
Sources & evidence
- ORD record
- ord-fe2c7be64aa544a48b353920753c829c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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