Ethanol → HCID 19700432, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[CH:14]2[CH2:15][CH:16]([C:49](=[O:50])[O:51][C:52]([CH3:53])([CH3:54])[CH3:55])[N:17]([C:26]([CH2:27][NH:28][C:29](=[O:30])[NH:31][c:32]3[cH:33][c:34]([C:38](=[O:39])[O:40][CH2:41][c:42]4[cH:43][cH:44][cH:45][cH:46][cH:47]4)[cH:35][cH:36][cH:37]3)=[O:48])[CH:18]2[c:19]2[c:20]([F:25])[cH:21][cH:22][cH:23][cH:24]2)[cH:9][cH:10]1.[CH3:56][CH2:57][OH:58]>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[CH:14]2[CH2:15][CH:16]([C:49](=[O:50])[O:51][C:52]([CH3:53])([CH3:54])[CH3:55])[N:17]([C:26]([CH2:27][NH:28][C:29](=[O:30])[NH:31][c:32]3[cH:33][c:34]([C:38](=[O:39])[OH:40])[cH:35][cH:36][cH:37]3)=[O:48])[CH:18]2[c:19]2[c:20]([F:25])[cH:21][cH:22][cH:23][cH:24]2)[cH:9][cH:10]1Participants
3
Sources & evidence
- ORD record
- ord-0df16c3c9b7a4bd3a2b0f27c395168d2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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