Ethanol → HCID 21201596, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[C:5](=[O:6])[CH2:7][N:8]1[C:9](=[O:41])[CH:10]([NH:26][C:27](=[O:28])[NH:29][c:30]2[cH:31][c:32]([C:36](=[O:37])[O:38][CH2:39][CH3:40])[cH:33][cH:34][cH:35]2)[CH2:11][N:12]([c:19]2[c:20]([F:25])[cH:21][cH:22][cH:23][cH:24]2)[c:13]2[c:14]1[cH:15][cH:16][cH:17][cH:18]2.[CH3:45][OH:46].[CH3:52][CH2:53][OH:54].[Li+:44].[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1.[OH-:43].[OH2:42]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[C:5](=[O:6])[CH2:7][N:8]1[C:9](=[O:41])[CH:10]([NH:26][C:27](=[O:28])[NH:29][c:30]2[cH:31][c:32]([C:36](=[O:37])[OH:38])[cH:33][cH:34][cH:35]2)[CH2:11][N:12]([c:19]2[c:20]([F:25])[cH:21][cH:22][cH:23][cH:24]2)[c:13]2[c:14]1[cH:15][cH:16][cH:17][cH:18]2Participants
8
Sources & evidence
- ORD record
- ord-07a0564b39e046bb94e7ec7769fef0dd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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