Ethanol → HCID 178442183, compound
Reaction equation
[C:3]([CH3:4])([CH3:5])([CH3:6])[O:7][C:8]([NH:9][CH:10]([CH2:11][C:12]([CH2:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([O:21][CH2:22][CH:23]2[O:24][C:25]([CH3:28])([CH3:29])[O:26][CH2:27]2)[cH:19][cH:20]1)([CH3:30])[CH3:31])[CH2:32][N:33]1[C:34](=[O:35])[c:36]2[c:37]([cH:38][cH:39][cH:40][cH:41]2)[C:42]1=[O:43])=[O:44].[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:45][CH2:46][O:47][CH2:48][CH3:49].[CH3:55][CH2:56][OH:57].[NH2:1][NH2:2]>>[C:3]([CH3:4])([CH3:5])([CH3:6])[O:7][C:8]([NH:9][CH:10]([CH2:11][C:12]([CH2:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([O:21][CH2:22][CH:23]2[O:24][C:25]([CH3:28])([CH3:29])[O:26][CH2:27]2)[cH:19][cH:20]1)([CH3:30])[CH3:31])[CH2:32][NH2:33])=[O:44]Participants
6
Sources & evidence
- ORD record
- ord-a93143352bf549c39febc494cf7c4474
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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