Ethanol → HCID 25254940, compound
Reaction equation
[CH3:50][CH2:51][OH:52].[CH:1]1([N:7]2[c:8]3[c:9]([cH:18][n:19][c:20]([NH:22][c:23]4[c:24]([O:48][CH3:49])[cH:25][c:26]([C:27](=[O:28])[NH:29][N:30]5[CH2:31][CH2:32][N:33]([C:36]([O:37][CH2:38][c:39]6[cH:40][cH:41][cH:42][cH:43][cH:44]6)=[O:45])[CH2:34][CH2:35]5)[cH:46][cH:47]4)[n:21]3)[N:10]([CH3:17])[C:11](=[O:16])[C:12]([F:14])([F:15])[CH2:13]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1>>[CH:1]1([N:7]2[c:8]3[c:9]([cH:18][n:19][c:20]([NH:22][c:23]4[c:24]([O:48][CH3:49])[cH:25][c:26]([C:27](=[O:28])[NH:29][N:30]5[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]5)[cH:46][cH:47]4)[n:21]3)[N:10]([CH3:17])[C:11](=[O:16])[C:12]([F:14])([F:15])[CH2:13]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
3
Sources & evidence
- ORD record
- ord-fd96fee4f1e749b88b776bace991d637
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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