Ethanol → HCID 178442042, compound
Reaction equation
[CH3:1][C:2]([CH:3]([NH:4][C:5](=[O:6])[O:7][CH:8]1[CH:9]([CH2:11][CH2:12][CH2:13][CH:14]=[CH2:15])[CH2:10]1)[C:16](=[O:17])[N:18]1[CH:19]([C:20](=[O:21])[O:22][CH3:23])[CH2:24][CH:25]([O:27][c:28]2[n:29][c:30]3[cH:31][c:32]([O:39][CH3:40])[cH:33][cH:34][c:35]3[n:36][c:37]2[Cl:38])[CH2:26]1)([CH3:41])[CH3:42].[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[CH3:50][CH2:51][OH:52].[CH3:54][CH2:55][O:56][C:57]([CH3:58])=[O:59].[OH2:53]>>[CH3:1][C:2]([CH:3]([NH:4][C:5](=[O:6])[O:7][CH:8]1[CH:9]([CH2:11][CH2:12][CH2:13][CH:14]=[CH2:15])[CH2:10]1)[C:16](=[O:17])[N:18]1[CH:19]([C:20](=[O:21])[O:22][CH3:23])[CH2:24][CH:25]([O:27][c:28]2[n:29][c:30]3[cH:31][c:32]([O:39][CH3:40])[cH:33][cH:34][c:35]3[n:36][c:37]2[CH:43]=[CH2:44])[CH2:26]1)([CH3:41])[CH3:42]Participants
6
Sources & evidence
- ORD record
- ord-eeb80ccf6362459d9e3d2535f80000cb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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