Ethanol → HCID 140409614, compound
Reaction equation
[CH2:51]([OH:52])[CH3:53].[Cl:54][CH2:55][Cl:56].[c:1]1([N:7]([C:8](=[O:9])[c:10]2[cH:11][c:12]3[c:13]([n:14]([CH3:37])[c:15]([CH2:17][NH:18][c:19]4[cH:20][cH:21][c:22]([C:25]([NH:26][C:27](=[O:28])[O:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH3:35])=[NH:36])[cH:23][cH:24]4)[n:16]3)[cH:38][cH:39]2)[CH2:40][CH2:41][CH2:42][O:43][CH2:44][c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([N:7]([C:8](=[O:9])[c:10]2[cH:11][c:12]3[c:13]([n:14]([CH3:37])[c:15]([CH2:17][NH:18][c:19]4[cH:20][cH:21][c:22]([C:25]([NH:26][C:27](=[O:28])[O:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH3:35])=[NH:36])[cH:23][cH:24]4)[n:16]3)[cH:38][cH:39]2)[CH2:40][CH2:41][CH2:42][OH:43])[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
4
Sources & evidence
- ORD record
- ord-8882bb39d1194db197398d677f262fdb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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