Ethanol → HCID 44227313, compound
Reaction equation
[CH3:37][CH:38]([OH:39])[CH3:40].[CH3:41][CH2:42][CH2:43][CH2:44][CH2:45][CH3:46].[CH3:47][CH2:48][OH:49].[CH:1]1([CH:7]([c:8]2[o:9][c:10]3[c:11]([c:12]2[CH3:13])[cH:14][c:15]([F:18])[cH:16][cH:17]3)[NH:19][c:20]2[cH:21][cH:22][c:23]([C:26](=[O:27])[N:28]([CH2:29][CH2:30][C:31](=[O:32])[O:33][CH2:34][CH3:35])[CH3:36])[cH:24][n:25]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Li+:50].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[OH-:51]>>[CH:1]1([CH:7]([c:8]2[o:9][c:10]3[c:11]([c:12]2[CH3:13])[cH:14][c:15]([F:18])[cH:16][cH:17]3)[NH:19][c:20]2[cH:21][cH:22][c:23]([C:26](=[O:27])[N:28]([CH2:29][CH2:30][C:31](=[O:32])[OH:33])[CH3:36])[cH:24][n:25]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
8
Sources & evidence
- ORD record
- ord-8ad7522256224b00b0e35a52d757342d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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