Ethanol → HCID 178488527, compound
Reaction equation
[CH3:31][O:32][c:33]1[cH:34][c:35]([CH:36]=[O:37])[cH:38][cH:39][c:40]1-[n:41]1[cH:42][n:43][c:44]([CH3:46])[cH:45]1.[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[CH3:58][CH2:59][OH:60].[F:4][c:5]1[cH:6][cH:7][c:8]([CH:11]2[CH2:12][CH2:13][CH2:14][CH:15]3[N:16]2[C:17](=[O:30])[CH:18]([P:22](=[O:23])([O:24][CH2:25][CH3:26])[O:27][CH2:28][CH3:29])[CH2:19][CH2:20][CH2:21]3)[cH:9][cH:10]1.[Li+:3].[O:53]1[CH2:54][CH2:55][CH2:56][CH2:57]1.[OH-:2].[OH2:1]>>[F:4][c:5]1[cH:6][cH:7][c:8]([CH:11]2[CH2:12][CH2:13][CH2:14][CH:15]3[N:16]2[C:17](=[O:30])[C:18](=[CH:36][c:35]2[cH:34][c:33]([O:32][CH3:31])[c:40](-[n:41]4[cH:42][n:43][c:44]([CH3:46])[cH:45]4)[cH:39][cH:38]2)[CH2:19][CH2:20][CH2:21]3)[cH:9][cH:10]1Participants
9
Sources & evidence
- ORD record
- ord-df5eafe2b25943f3aae061af9f88d4dc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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