Ethanol → HCID 178485993, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([F:6])[O:7][c:8]1[c:9]([N:39]([CH3:40])[C:41](=[O:42])[O:43][CH2:44][c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:10][c:11]([CH2:14][CH:15]([C:16]([NH:17][CH2:18][CH2:19][CH2:20][CH2:21][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)=[O:28])[NH:29][S:30](=[O:31])(=[O:32])[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[cH:12][cH:13]1)=[O:51].[CH3:54][CH2:55][OH:56].[K+:53].[OH-:52]>>[O:3]=[C:4]([CH:5]([F:6])[O:7][c:8]1[c:9]([N:39]([CH3:40])[C:41](=[O:42])[O:43][CH2:44][c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:10][c:11]([CH2:14][CH:15]([C:16]([NH:17][CH2:18][CH2:19][CH2:20][CH2:21][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)=[O:28])[NH:29][S:30](=[O:31])(=[O:32])[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[cH:12][cH:13]1)[OH:51]Participants
5
Sources & evidence
- ORD record
- ord-1f5ed22f3894488abd28cb7c89f593d2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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