Ethanol → HCID 178490755, compound
Reaction equation
[CH3:37][CH2:38][OH:39].[F:1][c:2]1[cH:3][c:4]([CH2:5][CH:6]2[NH:7][C:8](=[O:30])[O:9][CH:10]2[CH:11]2[N:12]([CH2:21][c:22]3[cH:23][cH:24][c:25]([O:28][CH3:29])[cH:26][cH:27]3)[CH2:13][c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]3[CH2:20]2)[cH:31][c:32]([F:34])[cH:33]1.[Li+:36].[OH-:35].[OH2:40]>>[F:1][c:2]1[cH:3][c:4]([CH2:5][CH:6]([NH2:7])[CH:10]([OH:9])[CH:11]2[N:12]([CH2:21][c:22]3[cH:23][cH:24][c:25]([O:28][CH3:29])[cH:26][cH:27]3)[CH2:13][c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]3[CH2:20]2)[cH:31][c:32]([F:34])[cH:33]1Participants
6
Sources & evidence
- ORD record
- ord-252c2e6710504b7685b688b709312e2f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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